BRD4

Bromodomain-containing protein 4 (protein hunk1)

Reviewed UniProt entries for BRD4 and its protein partners


UniProt code UniProt Name Protein Name Gene Name Organism Length
O60885 BRD4_HUMAN Bromodomain-containing protein 4 (Protein HUNK1) BRD4 HUNK1 Homo sapiens (Human) 1362
Q9ESU6 BRD4_MOUSE Bromodomain-containing protein 4 (Mitotic chromosome-associated protein) (MCAP) Brd4 Mcap Mus musculus (Mouse) 1400

Small molecules tested in BRD4 binding assays:

235 datapoints for 135 distinct small molecules


Name GW841819X
Affinity IC50 = 15.5nM
Assay description None
-- Direct single protein target assigned: BRD4_HUMAN (Expert curation) --
DOI http://pubs.acs.org/doi/abs/10.1021/jm200108t
Doc title Discovery and Characterization of Small Molecule Inhibitors of the BET Family Bromodomains
PDB 2YEL - (WSH)

Name GW841819X
Affinity IC50 = 15.5nM
Assay description None
-- Direct single protein target assigned: BRD4_HUMAN (Expert curation) --
DOI http://pubs.acs.org/doi/abs/10.1021/jm200108t
Doc title Discovery and Characterization of Small Molecule Inhibitors of the BET Family Bromodomains
PDB 2YEM - (WSH)

Name CHEMBL112
Affinity Activity < 5%
Assay description Binding affinity to His-6 tagged BRD4 expressed in Escherichia coli at 100 uM after 60 mins by fluorescence anisotropic analysis
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136404
Doc title Fragment-based discovery of bromodomain inhibitors part 1: inhibitor binding modes and implications for lead discovery.
PDB None

Name CHEMBL112
Affinity INH = 12%
Assay description Inhibition of His-6 tagged BRD4-RD12 precoupled with biotinylated tetra-acetylated histone H4 expressed in Escherichia coli assessed as protein-protein interaction at 50 uM after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136404
Doc title Fragment-based discovery of bromodomain inhibitors part 1: inhibitor binding modes and implications for lead discovery.
PDB None

Name CHEMBL1201169
Affinity Active
Assay description Binding affinity to BRD4-BD2 assessed as change in melting temperature at 10 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1201169
Affinity Active
Assay description Binding affinity to BRD4-BD1 assessed as change in melting temperature at 10 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1230189
Affinity Activity = 9%
Assay description Binding affinity to His-6 tagged BRD4 expressed in Escherichia coli at 100 uM after 60 mins by fluorescence anisotropic analysis
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136404
Doc title Fragment-based discovery of bromodomain inhibitors part 1: inhibitor binding modes and implications for lead discovery.
PDB 4DON - (3PF)

Name CHEMBL1230189
Affinity IC50 = 39uM
Assay description Inhibition of BRD4 isoform 1 by AlphaScreen assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23095041
Doc title Identification of a chemical probe for bromo and extra C-terminal bromodomain inhibition through optimization of a fragment-derived hit.
PDB 4DON - (3PF)

Name CHEMBL1230189
Affinity INH = 25%
Assay description Inhibition of His-6 tagged BRD4-RD12 precoupled with biotinylated tetra-acetylated histone H4 expressed in Escherichia coli assessed as protein-protein interaction at 50 uM after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136404
Doc title Fragment-based discovery of bromodomain inhibitors part 1: inhibitor binding modes and implications for lead discovery.
PDB 4DON - (3PF)

Name CHEMBL1232461
Affinity IC50 = 740nM
Assay description Inhibition of His6-tagged BRD4 expressed in Escherichia coli after 60 mins by fluorescence anisotropy assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL1232461
Affinity IC50 = 36.1nM
Assay description Displacement of tetra-acetylated H4 peptide from human Brd4 bromodomain BD12 after 1 hr by FRET analysis
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21568322
Doc title Discovery and characterization of small molecule inhibitors of the BET family bromodomains.
PDB None

Name CHEMBL1232461
Affinity IC50 = 190nM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL1232461
Affinity Kd = 49nM
Assay description Binding affinity to His6-tagged BRD4 expressed in Escherichia coli by isothermal colorimetric analysis
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL1232461
Affinity IC50 = 36.1nM
Assay description Displacement of acetylated histone peptide from BRD4-BD1,2 by FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22316554
Doc title Development of live-cell imaging probes for monitoring histone modifications.
PDB None

Name CHEMBL1232461
Affinity Kd = 55.2nM
Assay description Binding affinity to BRD4-BD1,2 by isothermal titration calorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22316554
Doc title Development of live-cell imaging probes for monitoring histone modifications.
PDB None

Name CHEMBL1232461
Affinity Dose-dependent effect
Assay description Displacement of tetra-acetylated H4 peptide from human Brd4 bromodomain BD12 after 1 hr by FRET analysis
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21568322
Doc title Discovery and characterization of small molecule inhibitors of the BET family bromodomains.
PDB None

Name CHEMBL12543
Affinity Activity < 5%
Assay description Binding affinity to His-6 tagged BRD4 expressed in Escherichia coli at 100 uM after 60 mins by fluorescence anisotropic analysis
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136404
Doc title Fragment-based discovery of bromodomain inhibitors part 1: inhibitor binding modes and implications for lead discovery.
PDB None

Name CHEMBL12543
Affinity INH < 5%
Assay description Inhibition of His-6 tagged BRD4-RD12 precoupled with biotinylated tetra-acetylated histone H4 expressed in Escherichia coli assessed as protein-protein interaction at 50 uM after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136404
Doc title Fragment-based discovery of bromodomain inhibitors part 1: inhibitor binding modes and implications for lead discovery.
PDB None

Name CHEMBL1738926
Affinity IC50 = 470nM
Assay description Inhibition of His6-tagged BRD4 expressed in Escherichia coli after 60 mins by fluorescence anisotropy assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL1738926
Affinity IC50 = 15.5nM
Assay description Displacement of acetylated histone peptide from BRD4-BD1,2 by FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22316554
Doc title Development of live-cell imaging probes for monitoring histone modifications.
PDB None

Name CHEMBL1738926
Affinity Kd = 52.5nM
Assay description Binding affinity to BRD4-BD1,2 by isothermal titration calorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22316554
Doc title Development of live-cell imaging probes for monitoring histone modifications.
PDB None

Name CHEMBL1738926
Affinity IC50 = 140nM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL1738926
Affinity Kd = 24nM
Assay description Binding affinity to His6-tagged BRD4 expressed in Escherichia coli by isothermal colorimetric analysis
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL1738926
Affinity Kd = 19nM
Assay description Binding affinity to BRD4 by isothermal titration calorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1828978
Affinity IC50 = 4.8uM
Assay description Displacement of H4Ac4 peptide from first bromodomain of human BRD4 by peptide displacement assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828978
Affinity IC50 = 7uM
Assay description Inhibition of first bromodomain of BRD4
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828978
Affinity deltaTm = 8degrees C
Assay description Binding affinity to first bromodomain of BRD4 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828978
Affinity deltaTm = 5.3degrees C
Assay description Binding affinity to second bromodomain of BRD4 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828979
Affinity IC50 = 0.8nM
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence anisotropy assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL1828979
Affinity deltaTm = 2degrees C
Assay description Binding affinity to first bromodomain of BRD4 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828979
Affinity Kd = 50nM
Assay description Binding affinity to human His-tagged bromodomain BRD4(1) by isothermal titration calorimetry
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL1828979
Affinity deltaTm = 2.6degrees C
Assay description Binding affinity to second bromodomain of BRD4 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828979
Affinity INH > 50%
Assay description Inhibition of bromodomain BRD4-mediated c-myc mRNA expression in human HT-29 cells at 10 uM after 24 hrs by RT-qPCR analysis relative to control
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL1828979
Affinity INH = 26%
Assay description Inhibition of His6-tagged BRD4 expressed in Escherichia coli at 200 uM after 60 mins by fluorescence anisotropy assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL1828979
Affinity IC50 = 84.2uM
Assay description Displacement of H4Ac4 peptide from first bromodomain of human BRD4 by peptide displacement assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828980
Affinity deltaTm = 1.9degrees C
Assay description Binding affinity to second bromodomain of BRD4 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828980
Affinity IC50 = 24.6uM
Assay description Displacement of H4Ac4 peptide from first bromodomain of human BRD4 by peptide displacement assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828980
Affinity deltaTm = 2.1degrees C
Assay description Binding affinity to first bromodomain of BRD4 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828981
Affinity IC50 = 23.2uM
Assay description Displacement of H4Ac4 peptide from first bromodomain of human BRD4 by peptide displacement assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828981
Affinity deltaTm = 2.8degrees C
Assay description Binding affinity to first bromodomain of BRD4 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828981
Affinity deltaTm = 4degrees C
Assay description Binding affinity to second bromodomain of BRD4 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828982
Affinity deltaTm = 6.3degrees C
Assay description Binding affinity to second bromodomain of BRD4 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828982
Affinity IC50 = 9.7uM
Assay description Displacement of H4Ac4 peptide from first bromodomain of human BRD4 by peptide displacement assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828982
Affinity deltaTm = 5.4degrees C
Assay description Binding affinity to first bromodomain of BRD4 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828983
Affinity deltaTm = 3.7degrees C
Assay description Binding affinity to first bromodomain of BRD4 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828983
Affinity deltaTm = 3.8degrees C
Assay description Binding affinity to second bromodomain of BRD4 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828983
Affinity IC50 = 7.7uM
Assay description Displacement of H4Ac4 peptide from first bromodomain of human BRD4 by peptide displacement assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828984
Affinity IC50 = 51.2uM
Assay description Displacement of H4Ac4 peptide from first bromodomain of human BRD4 by peptide displacement assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828984
Affinity deltaTm = 2.3degrees C
Assay description Binding affinity to first bromodomain of BRD4 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828984
Affinity deltaTm = 2.2degrees C
Assay description Binding affinity to second bromodomain of BRD4 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828985
Affinity deltaTm = 5.1degrees C
Assay description Binding affinity to first bromodomain of BRD4 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828985
Affinity deltaTm = 6.5degrees C
Assay description Binding affinity to second bromodomain of BRD4 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828985
Affinity IC50 = 7.5uM
Assay description Displacement of H4Ac4 peptide from first bromodomain of human BRD4 by peptide displacement assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB None

Name CHEMBL1828986
Affinity IC50 = 4.8uM
Assay description Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23517011
Doc title Optimization of 3,5-dimethylisoxazole derivatives as potent bromodomain ligands.
PDB 3SVG - (ODR)

Name CHEMBL1828986
Affinity IC50 = 4.8uM
Assay description Displacement of H4Ac4 peptide from first bromodomain of human BRD4 by peptide displacement assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB 3SVG - (ODR)

Name CHEMBL1828986
Affinity deltaTm = 8.5degrees C
Assay description Binding affinity to first bromodomain of BRD4 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB 3SVG - (ODR)

Name CHEMBL1828986
Affinity deltaTm = 8degrees C
Assay description Binding affinity to second bromodomain of BRD4 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB 3SVG - (ODR)

Name CHEMBL1950955
Affinity Activity = 42%
Assay description Binding affinity to His-6 tagged BRD4 expressed in Escherichia coli at 100 uM after 60 mins by fluorescence anisotropic analysis
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136404
Doc title Fragment-based discovery of bromodomain inhibitors part 1: inhibitor binding modes and implications for lead discovery.
PDB None

Name CHEMBL1950955
Affinity INH = 35%
Assay description Inhibition of His-6 tagged BRD4-RD12 precoupled with biotinylated tetra-acetylated histone H4 expressed in Escherichia coli assessed as protein-protein interaction at 50 uM after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136404
Doc title Fragment-based discovery of bromodomain inhibitors part 1: inhibitor binding modes and implications for lead discovery.
PDB None

Name CHEMBL1950956
Affinity IC50 = 10uM
Assay description Inhibition of His-6 tagged BRD4 expressed in Escherichia coli after 60 mins by fluorescence anisotropic analysis
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136404
Doc title Fragment-based discovery of bromodomain inhibitors part 1: inhibitor binding modes and implications for lead discovery.
PDB None

Name CHEMBL1950956
Affinity IC50 = 2uM
Assay description Inhibition of His-6 tagged BRD4-RD12 interaction precoupled with biotinylated tetra-acetylated histone H4 expressed in Escherichia coli after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136404
Doc title Fragment-based discovery of bromodomain inhibitors part 1: inhibitor binding modes and implications for lead discovery.
PDB None

Name CHEMBL1950957
Affinity IC50 = 30uM
Assay description Inhibition of His-6 tagged BRD4 expressed in Escherichia coli after 60 mins by fluorescence anisotropic analysis
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136404
Doc title Fragment-based discovery of bromodomain inhibitors part 1: inhibitor binding modes and implications for lead discovery.
PDB 4A9L - (P9L)

Name CHEMBL1957266
Affinity IC50 = 33nM
Assay description Inhibition of human C-terminal BRD4 bromodomain expressed in Escherichia coli BL21(DE3) after 30 mins by luminescence proximity homogeneous assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL1957266
Affinity Kd = 90.1nM
Assay description Binding affinity to BRD4-BD2 by isothermal titration calorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22316554
Doc title Development of live-cell imaging probes for monitoring histone modifications.
PDB None

Name CHEMBL1957266
Affinity IC50 = 33nM
Assay description Displacement of acetylated histone peptide from BRD4-BD2 by luminescence proximity homogenous assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22316554
Doc title Development of live-cell imaging probes for monitoring histone modifications.
PDB None

Name CHEMBL1957266
Affinity IC50 = 77nM
Assay description Displacement of acetylated histone peptide from BRD4-BD1 by luminescence proximity homogenous assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22316554
Doc title Development of live-cell imaging probes for monitoring histone modifications.
PDB None

Name CHEMBL1957266
Affinity Kd = 49nM
Assay description Binding affinity to BRD4-BD1 by isothermal titration calorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22316554
Doc title Development of live-cell imaging probes for monitoring histone modifications.
PDB None

Name CHEMBL1957266
Affinity Kd = 0.049uM
Assay description Binding affinity to BRD4-BD1 by isothermal titration calorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1957266
Affinity Kd = 60nM
Assay description Binding affinity to BRD4 by isothermal titration calorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1957266
Affinity deltaTm = 9.3degrees C
Assay description Binding affinity to BRD4-BD1 assessed as change in melting temperature by isothermal titration calorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1957266
Affinity IC50 = 77nM
Assay description Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23517011
Doc title Optimization of 3,5-dimethylisoxazole derivatives as potent bromodomain ligands.
PDB None

Name CHEMBL1957266
Affinity Kd = 49nM
Assay description Binding affinity to BRD4 isoform 1
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22924434
Doc title Progress in the development and application of small molecule inhibitors of bromodomain-acetyl-lysine interactions.
PDB None

Name CHEMBL1957266
Affinity IC50 = 77nM
Assay description Displacement of H4(1-21)KAc5,8,12,16 peptide from BRD4 isoform 1 bead based amplified luminescent proximity homogeneous assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22924434
Doc title Progress in the development and application of small molecule inhibitors of bromodomain-acetyl-lysine interactions.
PDB None

Name CHEMBL1957266
Affinity IC50 = 77nM
Assay description Inhibition of human N-terminal BRD4 bromodomain expressed in Escherichia coli BL21(DE3) after 30 mins by luminescence proximity homogeneous assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL1958335
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD4-BD1 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958335
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD4-BD2 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958336
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD4-BD1 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958336
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD4-BD2 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958337
Affinity Kd = 0.64uM
Assay description Binding affinity to BRD4-BD1 by isothermal titration calorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958337
Affinity Active
Assay description Binding affinity to BRD4-BD2 assessed as change in melting temperature at 10 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958337
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD4-BD1 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958337
Affinity Active
Assay description Binding affinity to BRD4-BD1 assessed as change in melting temperature at 10 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958337
Affinity deltaTm = 4.2degrees C
Assay description Binding affinity to BRD4-BD1 assessed as change in melting temperature by isothermal titration calorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958337
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD4-BD2 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958338
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD4-BD1 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958338
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD4-BD2 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958339
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD4-BD2 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958339
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD4-BD1 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958340
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD4-BD1 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958340
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD4-BD2 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958341
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD4-BD1 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958341
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD4-BD2 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958342
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD4-BD1 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958342
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD4-BD2 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958343
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD4-BD1 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958343
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD4-BD2 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958344
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD4-BD1 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958344
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD4-BD2 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958345
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD4-BD1 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958345
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD4-BD2 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958346
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD4-BD2 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958346
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD4-BD1 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL1958347
Affinity Kd = 50nM
Assay description Binding affinity to BRD4 by isothermal titration calorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL2153434
Affinity IC50 = 15.5nM
Assay description Displacement of tetra-acetylated H4 peptide from human Brd4 bromodomain BD12 after 1 hr by FRET analysis
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21568322
Doc title Discovery and characterization of small molecule inhibitors of the BET family bromodomains.
PDB None

Name CHEMBL2153434
Affinity Kd = 19nM
Assay description Binding affinity to N-terminal portion of human Brd4 containing bromodomain BD12 expressed in Escherichia coli by isothermal titration calorimetric analysis
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21568322
Doc title Discovery and characterization of small molecule inhibitors of the BET family bromodomains.
PDB None

Name CHEMBL2153434
Affinity Dose-dependent effect
Assay description Displacement of tetra-acetylated H4 peptide from human Brd4 bromodomain BD12 after 1 hr by FRET analysis
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21568322
Doc title Discovery and characterization of small molecule inhibitors of the BET family bromodomains.
PDB None

Name CHEMBL2158203
Affinity Active
Assay description Binding affinity to modified phosphorylated human BRD4 phosphorylation-dependent interaction domain (287-530) expressed in Sf9 cells assessed as red fluorescence by SDS-PAGE method based one-bead binding assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21742492
Doc title Peptoid ligands that bind selectively to phosphoproteins.
PDB None

Name CHEMBL2158203
Affinity Not Active
Assay description Binding affinity to unmodified human BRD4 phosphorylation-dependent interaction domain (598-785) using fluorescein 5-maleimide by fluorescence polarization method
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21742492
Doc title Peptoid ligands that bind selectively to phosphoproteins.
PDB None

Name CHEMBL2158203
Affinity Not Active
Assay description Binding affinity to modified phosphorylated human BRD4 phosphorylation-dependent interaction domain (598-785) expressed in Sf9 cells assessed as red fluorescence by SDS-PAGE method based one-bead binding assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21742492
Doc title Peptoid ligands that bind selectively to phosphoproteins.
PDB None

Name CHEMBL2158203
Affinity Not Active
Assay description Binding affinity to unmodified human BRD4 phosphorylation-dependent interaction domain (287-530) expressed in Sf9 cells assessed as red fluorescence by SDS-PAGE method based one-bead binding assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21742492
Doc title Peptoid ligands that bind selectively to phosphoproteins.
PDB None

Name CHEMBL2158203
Affinity Active
Assay description Binding affinity to modified phosphorylated human BRD4 phosphorylation-dependent interaction domain (287-530) expressed in Sf9 cells assessed as red fluorescence in presence of CK2 enzyme by SDS-PAGE method based one-bead binding assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21742492
Doc title Peptoid ligands that bind selectively to phosphoproteins.
PDB None

Name CHEMBL2158203
Affinity Kd = 50uM
Assay description Binding affinity to modified phosphorylated human BRD4 phosphorylation-dependent interaction domain (598-785) using fluorescein 5-maleimide by fluorescence polarization method
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21742492
Doc title Peptoid ligands that bind selectively to phosphoproteins.
PDB None

Name CHEMBL2158203
Affinity Not Active
Assay description Binding affinity to non-phosphorylated human BRD4 phosphorylation-dependent interaction domain (287-530) expressed in Sf9 cells lysate assessed as phopho-PDID recovery using compound coated resion incubated with cell lysates by SDS-PAGE/Western blotting method
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21742492
Doc title Peptoid ligands that bind selectively to phosphoproteins.
PDB None

Name CHEMBL2158203
Affinity Not Active
Assay description Binding affinity to non-phosphorylated human BRD4 phosphorylation-dependent interaction domain (598-785) expressed in Sf9 cells assessed as red fluorescence by SDS-PAGE method based one-bead binding assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21742492
Doc title Peptoid ligands that bind selectively to phosphoproteins.
PDB None

Name CHEMBL2158203
Affinity Activity = 20%
Assay description Binding affinity to modified phosphorylated human BRD4 phosphorylation-dependent interaction domain (287-530) expressed in Sf9 cells lysate assessed as phopho-PDID recovery using compound coated resion incubated with cell lysates by SDS-PAGE/Western blotting method
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21742492
Doc title Peptoid ligands that bind selectively to phosphoproteins.
PDB None

Name CHEMBL2158203
Affinity Not Active
Assay description Binding affinity to modified dephosphorylated human BRD4 phosphorylation-dependent interaction domain (287-530) expressed in Sf9 cells assessed as red fluorescence in presence of calf intestinal alkaline phosphatase by SDS-PAGE method based one-bead binding assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21742492
Doc title Peptoid ligands that bind selectively to phosphoproteins.
PDB None

Name CHEMBL2158204
Affinity Active
Assay description Binding affinity to modified phosphorylated human BRD4 phosphorylation-dependent interaction domain (598-785) expressed in Sf9 cells assessed as red fluorescence by SDS-PAGE method based one-bead binding assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21742492
Doc title Peptoid ligands that bind selectively to phosphoproteins.
PDB None

Name CHEMBL2179378
Affinity IC50 = 0.88uM
Assay description Inhibition of BRD4 isoform 1 by AlphaScreen assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23095041
Doc title Identification of a chemical probe for bromo and extra C-terminal bromodomain inhibition through optimization of a fragment-derived hit.
PDB None

Name CHEMBL2179379
Affinity IC50 = 0.88uM
Assay description Inhibition of BRD4 isoform 1 by AlphaScreen assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23095041
Doc title Identification of a chemical probe for bromo and extra C-terminal bromodomain inhibition through optimization of a fragment-derived hit.
PDB None

Name CHEMBL2179380
Affinity IC50 = 2.3uM
Assay description Inhibition of BRD4 isoform 1 by AlphaScreen assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23095041
Doc title Identification of a chemical probe for bromo and extra C-terminal bromodomain inhibition through optimization of a fragment-derived hit.
PDB None

Name CHEMBL2179381
Affinity IC50 = 23uM
Assay description Inhibition of BRD4 isoform 1 by AlphaScreen assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23095041
Doc title Identification of a chemical probe for bromo and extra C-terminal bromodomain inhibition through optimization of a fragment-derived hit.
PDB 4HBV - (15E)

Name CHEMBL2179382
Affinity IC50 = 4.8uM
Assay description Inhibition of BRD4 isoform 1 by AlphaScreen assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23095041
Doc title Identification of a chemical probe for bromo and extra C-terminal bromodomain inhibition through optimization of a fragment-derived hit.
PDB 4HBX - (14X)

Name CHEMBL2179383
Affinity IC50 = 1.9uM
Assay description Inhibition of BRD4 isoform 1 by AlphaScreen assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23095041
Doc title Identification of a chemical probe for bromo and extra C-terminal bromodomain inhibition through optimization of a fragment-derived hit.
PDB 4HBW - (14Z)

Name CHEMBL2179384
Affinity IC50 = 4.4uM
Assay description Inhibition of BRD4 isoform 1 by AlphaScreen assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23095041
Doc title Identification of a chemical probe for bromo and extra C-terminal bromodomain inhibition through optimization of a fragment-derived hit.
PDB 4HBY - (13F)

Name CHEMBL2179385
Affinity IC50 = 0.18uM
Assay description Inhibition of BRD4 isoform 1 by AlphaScreen assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23095041
Doc title Identification of a chemical probe for bromo and extra C-terminal bromodomain inhibition through optimization of a fragment-derived hit.
PDB None

Name CHEMBL2179386
Affinity IC50 = 0.22uM
Assay description Inhibition of BRD4 isoform 1 by AlphaScreen assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23095041
Doc title Identification of a chemical probe for bromo and extra C-terminal bromodomain inhibition through optimization of a fragment-derived hit.
PDB None

Name CHEMBL2179387
Affinity IC50 = 0.22uM
Assay description Inhibition of BRD4 isoform 1 by AlphaScreen assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23095041
Doc title Identification of a chemical probe for bromo and extra C-terminal bromodomain inhibition through optimization of a fragment-derived hit.
PDB 4E96 - (0NS)

Name CHEMBL2179387
Affinity deltaTm = 3.79degrees C
Assay description Binding affinity to BRD4 isoform 2 assessed as change in melting temperature at 10 uM by thermal shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23095041
Doc title Identification of a chemical probe for bromo and extra C-terminal bromodomain inhibition through optimization of a fragment-derived hit.
PDB 4E96 - (0NS)

Name CHEMBL2179387
Affinity IC50 = 220nM
Assay description Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23517011
Doc title Optimization of 3,5-dimethylisoxazole derivatives as potent bromodomain ligands.
PDB 4E96 - (0NS)

Name CHEMBL2179387
Affinity deltaTm = 6.48degrees C
Assay description Binding affinity to BRD4 isoform 1 assessed as change in melting temperature at 10 uM by thermal shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23095041
Doc title Identification of a chemical probe for bromo and extra C-terminal bromodomain inhibition through optimization of a fragment-derived hit.
PDB 4E96 - (0NS)

Name CHEMBL2179388
Affinity IC50 = 0.36uM
Assay description Inhibition of BRD4 isoform 1 by AlphaScreen assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23095041
Doc title Identification of a chemical probe for bromo and extra C-terminal bromodomain inhibition through optimization of a fragment-derived hit.
PDB None

Name CHEMBL2179389
Affinity IC50 = 0.39uM
Assay description Inhibition of BRD4 isoform 1 by AlphaScreen assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23095041
Doc title Identification of a chemical probe for bromo and extra C-terminal bromodomain inhibition through optimization of a fragment-derived hit.
PDB None

Name CHEMBL2179390
Affinity IC50 = 0.47uM
Assay description Inhibition of BRD4 isoform 1 by AlphaScreen assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23095041
Doc title Identification of a chemical probe for bromo and extra C-terminal bromodomain inhibition through optimization of a fragment-derived hit.
PDB None

Name CHEMBL2179391
Affinity IC50 = 0.73uM
Assay description Inhibition of BRD4 isoform 1 by AlphaScreen assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23095041
Doc title Identification of a chemical probe for bromo and extra C-terminal bromodomain inhibition through optimization of a fragment-derived hit.
PDB None

Name CHEMBL2181701
Affinity IC50 = 7.4uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181702
Affinity IC50 = 2.4uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181703
Affinity IC50 = 1uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181704
Affinity IC50 = 1.3uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181705
Affinity IC50 = 1.8uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181706
Affinity IC50 = 1.2uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181707
Affinity IC50 = 12uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181708
Affinity IC50 = 17uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181709
Affinity IC50 = 4.2uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181710
Affinity IC50 = 11uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181711
Affinity IC50 = 15uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181712
Affinity IC50 = 22uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181713
Affinity IC50 = 10uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181714
Affinity IC50 = 17uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181715
Affinity IC50 = 3.2uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181716
Affinity IC50 = 2.5uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181717
Affinity IC50 = 5.2uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181718
Affinity Kd = 2.75uM
Assay description Binding affinity to His6-tagged BRD4 expressed in Escherichia coli by surface plasmon resonance assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181718
Affinity deltaTm = 5degrees C
Assay description Inhibition of His6FLAG-tagged BRD4-BD12 expressed in Escherichia coli assessed as change in melting temperature at 100 uM by thermal shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181718
Affinity deltaTm = 2degrees C
Assay description Inhibition of His6FLAG-tagged BRD4-BD1 expressed in Escherichia coli assessed as change in melting temperature at 100 uM by thermal shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181718
Affinity RUmax = 25%
Assay description Binding affinity to His6-tagged BRD4 expressed in Escherichia coli by surface plasmon resonance assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181718
Affinity IC50 = 2.6uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181719
Affinity IC50 = 1uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181720
Affinity IC50 = 3uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181721
Affinity IC50 = 0.5uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181721
Affinity deltaTm = 5degrees C
Assay description Inhibition of His6FLAG-tagged BRD4-BD12 expressed in Escherichia coli assessed as change in melting temperature at 100 uM by thermal shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181721
Affinity deltaTm = 2degrees C
Assay description Inhibition of His6FLAG-tagged BRD4-BD1 expressed in Escherichia coli assessed as change in melting temperature at 100 uM by thermal shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181722
Affinity IC50 = 2.2uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181723
Affinity IC50 = 1.1uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181724
Affinity IC50 = 1.8uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181725
Affinity IC50 = 5.6uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181726
Affinity IC50 = 3uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181727
Affinity IC50 = 7.6uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181728
Affinity IC50 = 3.3uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181729
Affinity IC50 = 4.5uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181730
Affinity IC50 = 2.8uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181731
Affinity IC50 = 8.2uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181732
Affinity IC50 = 2.6uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181733
Affinity IC50 = 6uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181734
Affinity IC50 = 5.6uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181735
Affinity IC50 = 16uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181736
Affinity IC50 = 6.6uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181737
Affinity IC50 = 20uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181738
Affinity IC50 = 4.4uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181739
Affinity IC50 = 3.3uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181740
Affinity IC50 = 13uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181741
Affinity IC50 = 6.5uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2181742
Affinity IC50 = 2uM
Assay description Inhibition of His6-tagged BRD4-BD12 expressed in Escherichia coli assessed as inhibition of binding to SGRG-K(Ac)-GG-K(Ac)-GLG-K(Ac)-GGA-K(Ac)-RHGSGSK-biotin after 1 hr by TR-FRET assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22136469
Doc title Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.
PDB None

Name CHEMBL2331593
Affinity IC50 = 1.36uM
Assay description Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23517011
Doc title Optimization of 3,5-dimethylisoxazole derivatives as potent bromodomain ligands.
PDB None

Name CHEMBL2335144
Affinity IC50 = 1.38uM
Assay description Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23517011
Doc title Optimization of 3,5-dimethylisoxazole derivatives as potent bromodomain ligands.
PDB None

Name CHEMBL2335145
Affinity IC50 = 1.17uM
Assay description Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23517011
Doc title Optimization of 3,5-dimethylisoxazole derivatives as potent bromodomain ligands.
PDB None

Name CHEMBL2335146
Affinity IC50 = 0.544uM
Assay description Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23517011
Doc title Optimization of 3,5-dimethylisoxazole derivatives as potent bromodomain ligands.
PDB None

Name CHEMBL2335147
Affinity Kd = 0.36uM
Assay description Binding affinity to human N-His-tagged BRD4 bromodomain 1 by surface plasmon resonance analysis
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23517011
Doc title Optimization of 3,5-dimethylisoxazole derivatives as potent bromodomain ligands.
PDB 4J0S - (1H3)

Name CHEMBL2335147
Affinity IC50 = 0.386uM
Assay description Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23517011
Doc title Optimization of 3,5-dimethylisoxazole derivatives as potent bromodomain ligands.
PDB 4J0S - (1H3)

Name CHEMBL2335148
Affinity IC50 = 3.9uM
Assay description Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23517011
Doc title Optimization of 3,5-dimethylisoxazole derivatives as potent bromodomain ligands.
PDB None

Name CHEMBL2335149
Affinity IC50 = 1.7uM
Assay description Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23517011
Doc title Optimization of 3,5-dimethylisoxazole derivatives as potent bromodomain ligands.
PDB None

Name CHEMBL2335150
Affinity IC50 = 2.6uM
Assay description Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23517011
Doc title Optimization of 3,5-dimethylisoxazole derivatives as potent bromodomain ligands.
PDB None

Name CHEMBL2335151
Affinity IC50 = 1.5uM
Assay description Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23517011
Doc title Optimization of 3,5-dimethylisoxazole derivatives as potent bromodomain ligands.
PDB None

Name CHEMBL2335152
Affinity IC50 = 0.64uM
Assay description Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23517011
Doc title Optimization of 3,5-dimethylisoxazole derivatives as potent bromodomain ligands.
PDB None

Name CHEMBL2335153
Affinity IC50 = 0.371uM
Assay description Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23517011
Doc title Optimization of 3,5-dimethylisoxazole derivatives as potent bromodomain ligands.
PDB None

Name CHEMBL2335154
Affinity IC50 = 0.382uM
Assay description Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23517011
Doc title Optimization of 3,5-dimethylisoxazole derivatives as potent bromodomain ligands.
PDB 4J0S - (1H3)

Name CHEMBL2335154
Affinity Kd = 0.39uM
Assay description Binding affinity to human N-His-tagged BRD4 bromodomain 1 by surface plasmon resonance analysis
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23517011
Doc title Optimization of 3,5-dimethylisoxazole derivatives as potent bromodomain ligands.
PDB 4J0S - (1H3)

Name CHEMBL2335155
Affinity IC50 = 180nM
Assay description Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23517011
Doc title Optimization of 3,5-dimethylisoxazole derivatives as potent bromodomain ligands.
PDB None

Name CHEMBL2346691
Affinity IC50 = 22.8uM
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence anisotropy assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349340
Affinity IC50 = 58.7nM
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence anisotropy assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349340
Affinity IC50 = 0.36uM
Assay description Inhibition of bromodomain BRD4-mediated c-myc mRNA expression in human HT-29 cells after 24 hrs by RT-qPCR analysis relative to control
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349341
Affinity IC50 = 24uM
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence anisotropy assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349342
Affinity IC50 = 42uM
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence anisotropy assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349343
Affinity IC50 = 51uM
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence anisotropy assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349344
Affinity IC50 = 23.8uM
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence anisotropy assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349345
Affinity IC50 = 50.7uM
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence anisotropy assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349346
Affinity IC50 = 4.4uM
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence anisotropy assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349347
Affinity IC50 = 4.1uM
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence anisotropy assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349348
Affinity INH = 45.7%
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) at 50 uM after 4 hrs by fluorescence anisotropy assay relative to control
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349349
Affinity IC50 = 4.1uM
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence anisotropy assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349350
Affinity IC50 = 3.7uM
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence anisotropy assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349351
Affinity IC50 = 10uM
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence anisotropy assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349352
Affinity INH = 45.6%
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) at 50 uM after 4 hrs by fluorescence anisotropy assay relative to control
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349353
Affinity INH = 38.6%
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) at 50 uM after 4 hrs by fluorescence anisotropy assay relative to control
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349354
Affinity IC50 = 3.3uM
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence anisotropy assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349355
Affinity IC50 = 2.6uM
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence anisotropy assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349355
Affinity INH > 50%
Assay description Inhibition of bromodomain BRD4-mediated c-myc mRNA expression in human HT-29 cells at 10 uM after 24 hrs by RT-qPCR analysis relative to control
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349356
Affinity IC50 = 3.5uM
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence anisotropy assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349357
Affinity IC50 = 2.6uM
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence anisotropy assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349358
Affinity IC50 = 2.4uM
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence anisotropy assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349359
Affinity IC50 = 2.5uM
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence anisotropy assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349360
Affinity INH = 20.2%
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) at 50 uM after 4 hrs by fluorescence anisotropy assay relative to control
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349361
Affinity IC50 = 0.23uM
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence anisotropy assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349362
Affinity IC50 = 2.2uM
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence anisotropy assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349363
Affinity IC50 = 0.57uM
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence anisotropy assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL2349462
Affinity IC50 = 0.79uM
Assay description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence anisotropy assay
-- Direct single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/23530754
Doc title Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.
PDB None

Name CHEMBL52030
Affinity Active
Assay description Binding affinity to BRD4-BD2 assessed as change in melting temperature at 10 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL52030
Affinity Active
Assay description Binding affinity to BRD4-BD1 assessed as change in melting temperature at 10 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL646
Affinity Active
Assay description Binding affinity to BRD4-BD2 assessed as change in melting temperature at 10 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL646
Affinity Active
Assay description Binding affinity to BRD4-BD1 assessed as change in melting temperature at 10 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL655
Affinity Active
Assay description Binding affinity to BRD4-BD1 assessed as change in melting temperature at 10 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL655
Affinity Active
Assay description Binding affinity to BRD4-BD2 assessed as change in melting temperature at 10 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL661
Affinity Active
Assay description Binding affinity to BRD4-BD1 assessed as change in melting temperature at 10 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL661
Affinity deltaTm = 4.7degrees C
Assay description Binding affinity to BRD4-BD1 assessed as change in melting temperature by isothermal titration calorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL661
Affinity Kd = 2.46uM
Assay description Binding affinity to BRD4-BD1 by isothermal titration calorimetry
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

Name CHEMBL661
Affinity Active
Assay description Binding affinity to BRD4-BD2 assessed as change in melting temperature at 10 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD4_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/22137933
Doc title Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.
PDB None

64 PDB entries for BRD4 and its protein partners


2DWW
Crystal structure of Bromodomain-containing protein 4

Entity type Code Description
polypeptide(L) Q9ESU6 Bromodomain-containing protein 4

2I8N
Solution structure of the second bromodomain of Brd4

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4

2JNS
Solution structure of the Bromodomain-containing protein 4 ET domain

Entity type Code Description
polypeptide(L) Q9ESU6 Bromodomain-containing protein 4

2LSP
Down-regulation of NF-kappa B transcriptional activity in HIV-associated kidney disease by BRD4 inhibition.

Entity type Code Description
polypeptide(L) Q04206 NF-kB-K310ac peptide
polypeptide(L) O60885 Bromodomain-containing protein 4

2NNU
Structure of the Papillomavirus DNA-Tethering Complex E2:Brd4 and a Peptide that Ablates HPV Chromosomal Association.

Entity type Code Description
polypeptide(L) P03120 Regulatory protein E2
polypeptide(L) O60885 Bromodomain-containing protein 4

2OSS
Histone recognition and large-scale structural analysis of the human bromodomain family.

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4

2OUO
Histone recognition and large-scale structural analysis of the human bromodomain family.

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4

2YEL
Discovery and Characterization of Small Molecule Inhibitors of the Bet Family Bromodomains.

Entity type Code Description
polypeptide(L) O60885 HUMAN BRD4
Ligand WSH BENZYL [(4R)-1-METHYL-6-PHENYL-4H-[1,2,4]TRIAZOLO[4,3-A][1,4]BENZODIAZEPIN-4-YL]CARBAMATE

2YEM
Discovery and Characterization of Small Molecule Inhibitors of the Bet Family Bromodomains.

Entity type Code Description
polypeptide(L) O60885 BROMODOMAIN-CONTAINING PROTEIN 4
Ligand WSH BENZYL [(4R)-1-METHYL-6-PHENYL-4H-[1,2,4]TRIAZOLO[4,3-A][1,4]BENZODIAZEPIN-4-YL]CARBAMATE

3JVJ
Structures of the Dual Bromodomains of the P-TEFb-activating Protein Brd4 at Atomic Resolution

Entity type Code Description
polypeptide(L) Q9ESU6 Bromodomain-containing protein 4

3JVK
Structures of the Dual Bromodomains of the P-TEFb-activating Protein Brd4 at Atomic Resolution

Entity type Code Description
polypeptide(L) Q9ESU6 Bromodomain-containing protein 4
polypeptide(L) P84243 histone H3.3 peptide

3JVL
Structures of the Dual Bromodomains of the P-TEFb-activating Protein Brd4 at Atomic Resolution

Entity type Code Description
polypeptide(L) Q9ESU6 Bromodomain-containing protein 4
Ligand BME BETA-MERCAPTOETHANOL

3JVM
Structures of the Dual Bromodomains of the P-TEFb-activating Protein Brd4 at Atomic Resolution

Entity type Code Description
polypeptide(L) Q9ESU6 Bromodomain-containing protein 4
Ligand BME BETA-MERCAPTOETHANOL

3MUK
Interaction of propionylated and butyrylated histone H3 lysine marks with Brd4 bromodomains

Entity type Code Description
polypeptide(L) Q9ESU6 Bromodomain-containing protein 4
polypeptide(L) P84243 peptide of Histone H3.3

3MUL
Interaction of propionylated and butyrylated histone H3 lysine marks with Brd4 bromodomains

Entity type Code Description
polypeptide(L) Q9ESU6 Bromodomain-containing protein 4
polypeptide(L) P84243 Peptide of Histone H3.3

3MXF
Selective inhibition of BET bromodomains.

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4
Ligand JQ1 (6S)-6-(2-TERT-BUTOXY-2-OXOETHYL)-4-(4-CHLOROPHENYL)-2,3,9-TRIMETHYL-6,7-DIHYDROTHIENO[3,2-F][1,2,4]TRIAZOLO[4,3-A][1,4]DIAZEPIN-10-IUM

3P5O
Suppression of inflammation by a synthetic histone mimic

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4
Ligand EAM 2-[(4S)-6-(4-CHLOROPHENYL)-8-METHOXY-1-METHYL-4H-[1,2,4]TRIAZOLO[4,3-A][1,4]BENZODIAZEPIN-4-YL]-N-ETHYLACETAMIDE

3SVF
Crystal Structure of the first bromodomain of human BRD4 in complex with a dihydro-quinazolin ligand

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4
Ligand WDR (4S)-6-(3,5-DIMETHYL-1,2-OXAZOL-4-YL)-4-(2-HYDROXYETHOXY)-3-METHYL-3,4-DIHYDROQUINAZOLIN-2(1H)-ONE

3SVG
Crystal Structure of the first bromodomain of human BRD4 in complex with a 3,5-dimethylisoxazol ligand

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4
Ligand ODR (1R)-1-[3-(3,5-DIMETHYL-1,2-OXAZOL-4-YL)-5-ETHOXYPHENYL]ETHANOL

3U5J
Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4
Ligand 08H 8-CHLORO-1-METHYL-6-PHENYL-4H-[1,2,4]TRIAZOLO[4,3-A][1,4]BENZODIAZEPINE

3U5K
Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4
Ligand 08J 8-CHLORO-6-(2-FLUOROPHENYL)-1-METHYL-4H-IMIDAZO[1,5-A][1,4]BENZODIAZEPINE

3U5L
Benzodiazepines and benzotriazepines as protein interaction inhibitors targeting bromodomains of the BET family.

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4
Ligand 08K 8-CHLORO-1,4-DIMETHYL-6-PHENYL-4H-[1,2,4]TRIAZOLO[4,3-A][1,3,4]BENZOTRIAZEPINE

3UVW
Histone recognition and large-scale structural analysis of the human bromodomain family.

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4
polypeptide(L) P62805 Histone H4

3UVX
Histone recognition and large-scale structural analysis of the human bromodomain family.

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4
polypeptide(L) 3UVX diacetylated histone 4 peptide

3UVY
Histone recognition and large-scale structural analysis of the human bromodomain family.

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4
polypeptide(L) P62805 Histone H4

3UW9
Histone recognition and large-scale structural analysis of the human bromodomain family.

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4
polypeptide(L) P62805 Histone H4
Ligand ALY N(6)-ACETYLLYSINE

3ZYU
Inhibition of Bet Recruitment to Chromatin as an Effective Treatment for Mll-Fusion Leukaemia.

Entity type Code Description
polypeptide(L) O60885 BROMODOMAIN-CONTAINING PROTEIN 4
Ligand 1GH 7-(3,5-DIMETHYL-1,2-OXAZOL-4-YL)-8-METHOXY-1-[(1R)-1-(PYRIDIN-2-YL)ETHYL]-1H,2H,3H-IMIDAZO[4,5-C]QUINOLIN-2-ONE

4A9L
Fragment-Based Discovery of Bromodomain Inhibitors Part 1: Inhibitor Binding Modes and Implications for Lead Discovery.

Entity type Code Description
polypeptide(L) O60885 BROMODOMAIN-CONTAINING PROTEIN 4
Ligand P9L 1,3-DIMETHYL-6-(MORPHOLIN-4-YLSULFONYL)-3,4-DIHYDROQUINAZOLIN-2(1H)-ONE

4BJX
N-Terminal Bromodomain of Human Brd4 with Gsk1324726A (I-Bet726)

Entity type Code Description
polypeptide(L) O60885 BROMODOMAIN-CONTAINING PROTEIN 4
Ligand 73B 4-[(2S,4R)-1-ACETYL-4-[(4-CHLOROPHENYL)AMINO]-2-METHYL-1,2,3,4-TETRAHYDROQUINOLIN-6-YL]BENZOIC ACID

4BW1
Naphthyridines as Novel Bet Family Bromodomain Inhibitors.

Entity type Code Description
polypeptide(L) O60885 BROMODOMAIN-CONTAINING PROTEIN 4
Ligand S5B 4-[(2-TERT-BUTYLPHENYL)AMINO]-7-(3,5-DIMETHYL-1,2-OXAZOL-4-YL)QUINOLINE-3-CARBOXYLIC ACID

4BW2
Naphthyridines as Novel Bet Family Bromodomain Inhibitors.

Entity type Code Description
polypeptide(L) O60885 BROMODOMAIN-CONTAINING PROTEIN 4
Ligand UTH 4-((2-(TERT-BUTYL)PHENYL)AMINO)-7-(3,5-DIMETHYLISOXAZOL-4-YL)-1,8-NAPHTHYRIDINE-3-CARBOXYLIC ACID

4BW3
Naphthyridines as Novel Bet Family Bromodomain Inhibitors.

Entity type Code Description
polypeptide(L) O60885 BROMODOMAIN-CONTAINING PROTEIN 4
Ligand 9BM 4-((2-(TERT-BUTYL)PHENYL)AMINO)-7-(3,5-DIMETHYLISOXAZOL-4-YL)-6-METHOXY-1,5-NAPHTHYRIDINE-3-CARBOXYLIC ACID

4BW4
Naphthyridines as Novel Bet Family Bromodomain Inhibitors.

Entity type Code Description
polypeptide(L) O60885 BROMODOMAIN-CONTAINING PROTEIN 4
Ligand 9B6 7-(3,5-DIMETHYLISOXAZOL-4-YL)-8-METHOXY-1-(2-(TRIFLUOROMETHOXY)PHENYL)-1H-IMIDAZO[4,5-C][1,5]NAPHTHYRIDIN-2(3H)-ONE

4C66
Discovery of Epigenetic Regulator I-Bet762: Lead Optimization to Afford a Clinical Candidate Inhibitor of the Bet Bromodomains.

Entity type Code Description
polypeptide(L) O60885 BROMODOMAIN-CONTAINING PROTEIN 4
Ligand H4C 4-(2-CHLOROPHENYL)-2-ETHYL-9-METHYL-6,8-DIHYDROTHIENO[3,2-F][1,2,4]TRIAZOLO[4,3-A][1,4]DIAZEPIN-10-IUM

4C67
Discovery of Epigenetic Regulator I-Bet762: Lead Optimization to Afford a Clinical Candidate Inhibitor of the Bet Bromodomains.

Entity type Code Description
polypeptide(L) O60885 BROMODOMAIN-CONTAINING PROTEIN 4
Ligand L5S 13-METHYL-7-PHENYL-3-THIA-1,8,11,12-TETRAAZATRICYCLO TRIDECA-2(6),4,7,10,12-PENTAENE

4DON
Brd4 Bromodomain 1 complex with a fragment 3,4-Dihydro-3-methyl-2(1H)-quinazolinon

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4
Ligand 3PF 3-METHYL-3,4-DIHYDROQUINAZOLIN-2(1H)-ONE

4E96
Identification of a chemical probe for bromo and extra C-terminal bromodomain inhibition through optimization of a fragment-derived hit.

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4
Ligand 0NS 2-METHOXY-N-(3-METHYL-2-OXO-1,2,3,4-TETRAHYDROQUINAZOLIN-6-YL)BENZENESULFONAMIDE

4F3I
Down-regulation of NF-{kappa}B Transcriptional Activity in HIV-associated Kidney Disease by BRD4 Inhibition.

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4
Ligand 0S6 METHYL [(6S)-4-(4-CHLOROPHENYL)-2,3,9-TRIMETHYL-6H-THIENO[3,2-F][1,2,4]TRIAZOLO[4,3-A][1,4]DIAZEPIN-6-YL]ACETATE

4GPJ
The design and synthesis of 5- and 6-isoxazolylbenzimidazoles as selective inhibitors of the BET Bromodomains

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4
Ligand 0Q1 (1R)-6-(3,5-DIMETHYL-1,2-OXAZOL-4-YL)-1-PHENYL-2,3-DIHYDRO-1H-INDEN-1-OL

4HBV
Identification of a Chemical Probe for Bromo and Extra C-Terminal Bromodomain Inhibition through Optimization of a Fragment-Derived Hit.

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4
Ligand 15E 6-BROMO-3-METHYL-3,4-DIHYDROQUINAZOLIN-2(1H)-ONE

4HBW
Identification of a Chemical Probe for Bromo and Extra C-Terminal Bromodomain Inhibition through Optimization of a Fragment-Derived Hit.

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4
Ligand 14Z N-ETHYL-3-METHYL-2-OXO-1,2,3,4-TETRAHYDROQUINAZOLINE-6-SULFONAMIDE

4HBX
Identification of a Chemical Probe for Bromo and Extra C-Terminal Bromodomain Inhibition through Optimization of a Fragment-Derived Hit.

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4
Ligand 14X 3-METHYL-6-(PYRROLIDIN-1-YLSULFONYL)-3,4-DIHYDROQUINAZOLIN-2(1H)-ONE

4HBY
Identification of a Chemical Probe for Bromo and Extra C-Terminal Bromodomain Inhibition through Optimization of a Fragment-Derived Hit.

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4
Ligand 13F 3-METHYL-2-OXO-N-PHENYL-1,2,3,4-TETRAHYDROQUINAZOLINE-6-SULFONAMIDE

4HXK
Fragment-Based Drug Discovery of 2-Thiazolidinones as Inhibitors of the Histone Reader BRD4 Bromodomain.

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4
Ligand 1AJ 6,7-DIHYDROTHIENO[3,2-C]PYRIDIN-5(4H)-YL(1H-IMIDAZOL-1-YL)METHANONE

4HXL
Fragment-Based Drug Discovery of 2-Thiazolidinones as Inhibitors of the Histone Reader BRD4 Bromodomain.

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4
Ligand 1A9 3-CYCLOHEXYL-N-{3-(2-OXO-2,3-DIHYDRO-1,3-THIAZOL-4-YL)-5-[(THIOPHEN-2-YLSULFONYL)AMINO]PHENYL}PROPANAMIDE

4HXM
Fragment-Based Drug Discovery of 2-Thiazolidinones as Inhibitors of the Histone Reader BRD4 Bromodomain.

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4
Ligand 1A8 N-{3-(2-OXO-2,3-DIHYDRO-1,3-THIAZOL-4-YL)-5-[(THIOPHEN-2-YLSULFONYL)AMINO]PHENYL}BUTANAMIDE

4HXN
Fragment-Based Drug Discovery of 2-Thiazolidinones as Inhibitors of the Histone Reader BRD4 Bromodomain.

Entity type Code Description
polypeptide(L) O60885 Bromodomain-containing protein 4