BRD2

Bromodomain-containing protein 2

Reviewed UniProt entries for BRD2 and its protein partners


UniProt code UniProt Name Protein Name Gene Name Organism Length
Q32S26 BRD2_BOVIN Bromodomain-containing protein 2 BRD2 Bos taurus (Bovine) 803
Q5TJG6 BRD2_CANFA Bromodomain-containing protein 2 BRD2 Canis familiaris (Dog) (Canis lupus familiaris) 803
Q7JJ13 BRD2_MOUSE Bromodomain-containing protein 2 (Female sterile homeotic-related protein 1) (Fsrg-1) (Protein RING3) Brd2 Fsrg1 Kiaa4005 Ring3 Mus musculus (Mouse) 798
Q6MGA9 BRD2_RAT Bromodomain-containing protein 2 (Protein RING3) Brd2 Ring3 Rattus norvegicus (Rat) 798
P25440 BRD2_HUMAN Bromodomain-containing protein 2 (O27.1.1) (Really interesting new gene 3 protein) BRD2 KIAA9001 RING3 Homo sapiens (Human) 801

Small molecules tested in BRD2 binding assays:

160 datapoints for 88 distinct small molecules


Name Frag_6
Affinity TR-FRET @ 50uM = 23% Inh
Assay description TR-FRET
-- Direct single protein target assigned: BRD2_HUMAN (Expert curation) --
DOI http://pubs.acs.org/doi/full/10.1021/jm201320w
Doc title Fragment-Based Discovery of Bromodomain Inhibitors Part 1: Inhibitor Binding Modes and Implications for Lead Discovery
PDB 4A9E - (3PF)

Name Frag_7
Affinity TR-FRET @ 50uM <5% Inh
Assay description TR-FRET
-- Direct single protein target assigned: BRD2_HUMAN (Expert curation) --
DOI http://pubs.acs.org/doi/full/10.1021/jm201320w
Doc title Fragment-Based Discovery of Bromodomain Inhibitors Part 1: Inhibitor Binding Modes and Implications for Lead Discovery
PDB 4A9F - (MB3)

Name Frag_3
Affinity TR-FRET @ 50uM = 44% Inh
Assay description TR-FRET
-- Direct single protein target assigned: BRD2_HUMAN (Expert curation) --
DOI http://pubs.acs.org/doi/full/10.1021/jm201320w
Doc title Fragment-Based Discovery of Bromodomain Inhibitors Part 1: Inhibitor Binding Modes and Implications for Lead Discovery
PDB 4A9H - (TVP)

Name Frag_4
Affinity IC50 (TR-FRET) = 2uM
Assay description TR-FRET
-- Direct single protein target assigned: BRD2_HUMAN (Expert curation) --
DOI http://pubs.acs.org/doi/full/10.1021/jm201320w
Doc title Fragment-Based Discovery of Bromodomain Inhibitors Part 1: Inhibitor Binding Modes and Implications for Lead Discovery
PDB 4A9I - (P9I)

Name Paracetamol
Affinity TR-FRET @ 50uM = 6% Inh
Assay description TR-FRET
-- Direct single protein target assigned: BRD2_HUMAN (Expert curation) --
DOI http://pubs.acs.org/doi/full/10.1021/jm201320w
Doc title Fragment-Based Discovery of Bromodomain Inhibitors Part 1: Inhibitor Binding Modes and Implications for Lead Discovery
PDB 4A9J - (TYL)

Name Paracetamol
Affinity None
Assay description None
-- Direct single protein target assigned: CBP_HUMAN (Expert curation) --
DOI http://pubs.acs.org/doi/full/10.1021/jm201320w
Doc title Fragment-Based Discovery of Bromodomain Inhibitors Part 1: Inhibitor Binding Modes and Implications for Lead Discovery
PDB 4A9K - (TYL)

Name Frag_8
Affinity None
Assay description None
-- Direct single protein target assigned: BRD4_HUMAN (Expert curation) --
DOI http://pubs.acs.org/doi/full/10.1021/jm201320w
Doc title Fragment-Based Discovery of Bromodomain Inhibitors Part 1: Inhibitor Binding Modes and Implications for Lead Discovery
PDB 4A9L - (P9L)

Name Comp_6
Affinity IC50 (TR-FRET) = 0.5uM
Assay description TR-FRET
-- Direct single protein target assigned: BRD2_HUMAN (Expert curation) --
DOI http://pubs.acs.org/doi/full/10.1021/jm201283q
Doc title Fragment-Based Discovery of Bromodomain Inhibitors Part 2: Optimization of Phenylisoxazole Sulfonamides
PDB 4A9M - (P9M)

Name Comp_4
Affinity None
Assay description None
-- Direct single protein target assigned: BRD2_HUMAN (Expert curation) --
DOI http://pubs.acs.org/doi/full/10.1021/jm201283q
Doc title Fragment-Based Discovery of Bromodomain Inhibitors Part 2: Optimization of Phenylisoxazole Sulfonamides
PDB 4A9O - (A9O)

Name Comp_3
Affinity None
Assay description None
-- Direct single protein target assigned: BRD2_HUMAN (Expert curation) --
DOI http://pubs.acs.org/doi/full/10.1021/jm201283q
Doc title Fragment-Based Discovery of Bromodomain Inhibitors Part 2: Optimization of Phenylisoxazole Sulfonamides
PDB 4ALH - (A9P)

Name GW841819X
Affinity Kd = 46nM
Assay description None
-- Direct single protein target assigned: BRD2_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 2YDW - (WSH)

Name GSK525762
Affinity IC50 = 32.5nM
Assay description None
-- Direct single protein target assigned: BRD2_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 2YEK - (EAM)

Name CHEMBL112
Affinity INH = 6%
Assay description Inhibition of His-6 tagged BRD2-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: BRD2_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 Active
Assay description Binding affinity to His-6 tagged BRD2 expressed in Escherichia coli at 10 mM after 60 mins by fluorescence anisotropic analysis
-- Homologous single protein target assigned: BRD2_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 Activity = 11%
Assay description Binding affinity to His-6 tagged BRD2 expressed in Escherichia coli at 100 uM after 60 mins by fluorescence anisotropic analysis
-- Homologous single protein target assigned: BRD2_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 Not Active
Assay description Binding affinity to BRD2-BD1 assessed as change in melting temperature at 10 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 Not Active
Assay description Binding affinity to BRD2-BD2 assessed as change in melting temperature at 10 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 INH = 23%
Assay description Inhibition of His-6 tagged BRD2-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: BRD2_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 4A9E - (3PF)

Name CHEMBL1230189
Affinity Activity = 12%
Assay description Binding affinity to His-6 tagged BRD2 expressed in Escherichia coli at 100 uM after 60 mins by fluorescence anisotropic analysis
-- Homologous single protein target assigned: BRD2_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 4A9E - (3PF)

Name CHEMBL1232461
Affinity Dose-dependent effect
Assay description Displacement of tetra-acetylated H4 peptide from human Brd2 bromodomain BD12 after 1 hr by FRET analysis
-- Direct single protein target assigned: BRD2_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 = 810nM
Assay description Inhibition of His6-tagged BRD2 expressed in Escherichia coli after 60 mins by fluorescence anisotropy assay
-- Homologous single protein target assigned: BRD2_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 = 32.5nM
Assay description Displacement of tetra-acetylated H4 peptide from human Brd2 bromodomain BD12 after 1 hr by FRET analysis
-- Direct single protein target assigned: BRD2_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 = 32.5nM
Assay description Displacement of acetylated histone peptide from BRD2-BD1,2 by FRET assay
-- Homologous single protein target assigned: BRD2_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 = 61.3nM
Assay description Binding affinity to BRD2-BD1,2 by isothermal titration calorimetry
-- Homologous single protein target assigned: BRD2_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 IC50 = 150nM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 101nM
Assay description Binding affinity to His6-tagged BRD2 expressed in Escherichia coli by isothermal colorimetric analysis
-- Homologous single protein target assigned: BRD2_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 CHEMBL12543
Affinity INH < 5%
Assay description Inhibition of His-6 tagged BRD2-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: BRD2_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 4A9F - (MB3)

Name CHEMBL12543
Affinity Activity < 5%
Assay description Binding affinity to His-6 tagged BRD2 expressed in Escherichia coli at 100 uM after 60 mins by fluorescence anisotropic analysis
-- Homologous single protein target assigned: BRD2_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 4A9F - (MB3)

Name CHEMBL1738777
Affinity Kd = 28000nM
Assay description Binding affinity to BRD2-BD1 by SPR spectroscopy
-- Homologous single protein target assigned: BRD2_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 CHEMBL1738777
Affinity Kd = 28uM
Assay description Binding affinity to BRD2 isoform 1 by SPR
-- Homologous single protein target assigned: BRD2_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 CHEMBL1738926
Affinity IC50 = 820nM
Assay description Inhibition of His6-tagged BRD2 expressed in Escherichia coli after 60 mins by fluorescence anisotropy assay
-- Homologous single protein target assigned: BRD2_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 = 29.9nM
Assay description Displacement of acetylated histone peptide from BRD2-BD1,2 by FRET assay
-- Homologous single protein target assigned: BRD2_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 = 52nM
Assay description Binding affinity to BRD2-BD1,2 by isothermal titration calorimetry
-- Homologous single protein target assigned: BRD2_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 = 160nM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 52nM
Assay description Binding affinity to His6-tagged BRD2 expressed in Escherichia coli by isothermal colorimetric analysis
-- Homologous single protein target assigned: BRD2_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 CHEMBL1828978
Affinity IC50 = 3uM
Assay description Inhibition of first bromodomain of BRD2
-- Homologous single protein target assigned: BRD2_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 = 6.2degrees C
Assay description Binding affinity to second bromodomain of BRD2 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD2_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 = 5.4degrees C
Assay description Binding affinity to first bromodomain of BRD2 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD2_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 = 34.3uM
Assay description Displacement of H4Ac4 peptide from first bromodomain of human BRD2 by peptide displacement assay
-- Direct single protein target assigned: BRD2_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB 4ALH - (A9P)

Name CHEMBL1828979
Affinity deltaTm = 2.1degrees C
Assay description Binding affinity to second bromodomain of BRD2 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD2_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB 4ALH - (A9P)

Name CHEMBL1828979
Affinity deltaTm = 0.9degrees C
Assay description Binding affinity to first bromodomain of BRD2 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD2_HUMAN (Autocuration) --
DOI http://www.ncbi.nlm.nih.gov/pubmed/21851057
Doc title 3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.
PDB 4ALH - (A9P)

Name CHEMBL1828980
Affinity deltaTm = 1.3degrees C
Assay description Binding affinity to first bromodomain of BRD2 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD2_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 = 6uM
Assay description Displacement of H4Ac4 peptide from first bromodomain of human BRD2 by peptide displacement assay
-- Direct single protein target assigned: BRD2_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 = 2.6degrees C
Assay description Binding affinity to second bromodomain of BRD2 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD2_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 = 7.4uM
Assay description Displacement of H4Ac4 peptide from first bromodomain of human BRD2 by peptide displacement assay
-- Direct single protein target assigned: BRD2_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 = 3.7degrees C
Assay description Binding affinity to second bromodomain of BRD2 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD2_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 = 1.3degrees C
Assay description Binding affinity to first bromodomain of BRD2 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD2_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 = 5.6degrees C
Assay description Binding affinity to second bromodomain of BRD2 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD2_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 = 4.2uM
Assay description Displacement of H4Ac4 peptide from first bromodomain of human BRD2 by peptide displacement assay
-- Direct single protein target assigned: BRD2_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 = 3.3degrees C
Assay description Binding affinity to first bromodomain of BRD2 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD2_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 = 3.3degrees C
Assay description Binding affinity to second bromodomain of BRD2 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD2_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 = 3.3uM
Assay description Displacement of H4Ac4 peptide from first bromodomain of human BRD2 by peptide displacement assay
-- Direct single protein target assigned: BRD2_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 = 2.3degrees C
Assay description Binding affinity to first bromodomain of BRD2 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD2_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 = 28.2uM
Assay description Displacement of H4Ac4 peptide from first bromodomain of human BRD2 by peptide displacement assay
-- Direct single protein target assigned: BRD2_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 = 2.5degrees C
Assay description Binding affinity to second bromodomain of BRD2 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD2_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 = 1.1degrees C
Assay description Binding affinity to first bromodomain of BRD2 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD2_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 = 2.3uM
Assay description Displacement of H4Ac4 peptide from first bromodomain of human BRD2 by peptide displacement assay
-- Direct single protein target assigned: BRD2_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 = 3.2degrees C
Assay description Binding affinity to first bromodomain of BRD2 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD2_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 = 5.3degrees C
Assay description Binding affinity to second bromodomain of BRD2 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD2_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 deltaTm = 6.1degrees C
Assay description Binding affinity to first bromodomain of BRD2 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD2_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 deltaTm = 8.3degrees C
Assay description Binding affinity to second bromodomain of BRD2 assessed as change in melting temperature at 100 uM by differential scanning fluorimetry
-- Homologous single protein target assigned: BRD2_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 = 1.6uM
Assay description Displacement of H4Ac4 peptide from first bromodomain of human BRD2 by peptide displacement assay
-- Direct single protein target assigned: BRD2_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 CHEMBL1950955
Affinity INH = 44%
Assay description Inhibition of His-6 tagged BRD2-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: BRD2_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 4A9H - (TVP)

Name CHEMBL1950955
Affinity Activity = 44%
Assay description Binding affinity to His-6 tagged BRD2 expressed in Escherichia coli at 100 uM after 60 mins by fluorescence anisotropic analysis
-- Homologous single protein target assigned: BRD2_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 4A9H - (TVP)

Name CHEMBL1950956
Affinity IC50 = 2uM
Assay description Inhibition of His-6 tagged BRD2-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: BRD2_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 = 12.6uM
Assay description Inhibition of His-6 tagged BRD2 expressed in Escherichia coli after 60 mins by fluorescence anisotropic analysis
-- Homologous single protein target assigned: BRD2_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 BRD2 expressed in Escherichia coli after 60 mins by fluorescence anisotropic analysis
-- Homologous single protein target assigned: BRD2_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 CHEMBL1957266
Affinity Kd = 128.4nM
Assay description Binding affinity to BRD2-BD1 by isothermal titration calorimetry
-- Homologous single protein target assigned: BRD2_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 CHEMBL1958335
Affinity deltaTm <= 2degrees C
Assay description Binding affinity to BRD2-BD1 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD2 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD1 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD2 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD1 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD2 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD2 assessed as change in melting temperature at 10 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD1 assessed as change in melting temperature at 10 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD1 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD2 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD1 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD2 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD1 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD2 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD2 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD1 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD2 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD1 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD1 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD2 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD1 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD2 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD2 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD1 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD1 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD2 assessed as change in melting temperature at 100 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 Kd = 46nM
Assay description Binding affinity to N-terminal portion of human Brd2 containing bromodomain BD1 expressed in Escherichia coli at 16 degC by isothermal titration calorimetric analysis
-- Direct single protein target assigned: BRD2_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 = 52.5nM
Assay description Binding affinity to N-terminal portion of human Brd2 containing bromodomain BD2 expressed in Escherichia coli at 26 degC by isothermal titration calorimetric analysis
-- Direct single protein target assigned: BRD2_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 = 220nM
Assay description Binding affinity to human Brd2 containing bromodomain BD1 expressed in Escherichia coli assessed as dissociation constant at 25 degC by surface plasma resonance
-- Direct single protein target assigned: BRD2_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 Brd2 bromodomain BD12 after 1 hr by FRET analysis
-- Direct single protein target assigned: BRD2_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 Brd2 containing bromodomain BD12 expressed in Escherichia coli by isothermal titration calorimetric analysis
-- Direct single protein target assigned: BRD2_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 IC50 = 29.9nM
Assay description Displacement of tetra-acetylated H4 peptide from human Brd2 bromodomain BD12 after 1 hr by FRET analysis
-- Direct single protein target assigned: BRD2_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 = 54nM
Assay description Binding affinity to human Brd2 containing bromodomain BD2 expressed in Escherichia coli assessed as dissociation constant at 25 degC by surface plasma resonance
-- Direct single protein target assigned: BRD2_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 = 52nM
Assay description Binding affinity to N-terminal portion of human Brd2 containing bromodomain BD12 expressed in Escherichia coli at 26 degC by isothermal titration calorimetric analysis
-- Direct single protein target assigned: BRD2_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 CHEMBL2179387
Affinity deltaTm = 5.32degrees C
Assay description Binding affinity to BRD2 isoform 2 assessed as change in melting temperature at 10 uM by thermal shift assay
-- Homologous single protein target assigned: BRD2_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 deltaTm = 4.61degrees C
Assay description Binding affinity to BRD2 isoform 1 assessed as change in melting temperature at 10 uM by thermal shift assay
-- Homologous single protein target assigned: BRD2_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 = 8.1uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 2.2uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 0.8uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 0.8uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 1.7uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 1.1uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 14uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 16uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 BRD2 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: BRD2_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 BRD2 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: BRD2_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 = 19uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 31uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 11uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 9uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 3.6uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 1.5uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 3.6uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 1.5uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 1degrees C
Assay description Inhibition of His6FLAG-tagged BRD2-BD1 expressed in Escherichia coli assessed as change in melting temperature at 100 uM by thermal shift assay
-- Homologous single protein target assigned: BRD2_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 = 34%
Assay description Binding affinity to His6-tagged BRD2 expressed in Escherichia coli by surface plasmon resonance assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD12 expressed in Escherichia coli assessed as change in melting temperature at 100 uM by thermal shift assay
-- Homologous single protein target assigned: BRD2_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 = 3.14uM
Assay description Binding affinity to His6-tagged BRD2 expressed in Escherichia coli by surface plasmon resonance assay
-- Homologous single protein target assigned: BRD2_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 = 1.5uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 1.9uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 BRD2-BD12 expressed in Escherichia coli assessed as change in melting temperature at 100 uM by thermal shift assay
-- Homologous single protein target assigned: BRD2_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 4A9M - (P9M)

Name CHEMBL2181721
Affinity IC50 = 0.5uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 4A9M - (P9M)

Name CHEMBL2181721
Affinity deltaTm = 1degrees C
Assay description Inhibition of His6FLAG-tagged BRD2-BD1 expressed in Escherichia coli assessed as change in melting temperature at 100 uM by thermal shift assay
-- Homologous single protein target assigned: BRD2_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 4A9M - (P9M)

Name CHEMBL2181722
Affinity IC50 = 1.4uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 0.9uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 1.1uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 2.4uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 1.8uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 4.3uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 2.5uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 3.6uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 1.5uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 4.9uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 2uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 5.2uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 6uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 14uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 4.7uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 13uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 BRD2 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: BRD2_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 = 3.9uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 12uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 5.6uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 = 2.5uM
Assay description Inhibition of His6-tagged BRD2 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: BRD2_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 CHEMBL52030
Affinity Active
Assay description Binding affinity to BRD2-BD1 assessed as change in melting temperature at 10 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 Not Active
Assay description Binding affinity to BRD2-BD2 assessed as change in melting temperature at 10 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD1 assessed as change in melting temperature at 10 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD2 assessed as change in melting temperature at 10 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD1 assessed as change in melting temperature at 10 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD2 assessed as change in melting temperature at 10 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD1 assessed as change in melting temperature at 10 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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 BRD2-BD2 assessed as change in melting temperature at 10 uM by protein stability shift assay
-- Homologous single protein target assigned: BRD2_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

21 PDB entries for BRD2 and its protein partners


1X0J
Structural basis for acetylated histone H4 recognition by the human Brd2 bromodomain

Entity type Code Description
polypeptide(L) P25440 Bromodomain-containing protein 2
Ligand DTT 2,3-DIHYDROXY-1,4-DITHIOBUTANE
Ligand MES 2-(N-MORPHOLINO)-ETHANESULFONIC ACID

2DVQ
Structural Basis for Acetylated Histone H4 Recognition by the Human BRD2 Bromodomain.

Entity type Code Description
polypeptide(L) P25440 Bromodomain-containing protein 2
polypeptide(L) 2DVQ histone H4

2DVR
Structural Basis for Acetylated Histone H4 Recognition by the Human BRD2 Bromodomain.

Entity type Code Description
polypeptide(L) P25440 bromodomain-containing protein 2
polypeptide(L) 2DVR histone H4

2DVS
Structural Basis for Acetylated Histone H4 Recognition by the Human BRD2 Bromodomain.

Entity type Code Description
polypeptide(L) P25440 bromodomain-containing protein 2
polypeptide(L) 2DVS histone H4

2DVV
Crystal structure of the second bromodomain of the human Brd2 protein

Entity type Code Description
polypeptide(L) P25440 Bromodomain-containing protein 2
Ligand EPE 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID

2E3K
Structural basis for diacetylated histone H4 tail recognition by the second bromodomain of human BRD2

Entity type Code Description
polypeptide(L) P25440 Bromodomain-containing protein 2
polypeptide(L) P02309 15-mer peptide from Histone H4

2G4A
Solution structure of a Bromodomain from RING3

Entity type Code Description
polypeptide(L) P25440 Bromodomain-containing protein 2

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

Entity type Code Description
polypeptide(L) P25440 BROMODOMAIN-CONTAINING PROTEIN 2
Ligand WSH BENZYL [(4R)-1-METHYL-6-PHENYL-4H-[1,2,4]TRIAZOLO[4,3-A][1,4]BENZODIAZEPIN-4-YL]CARBAMATE

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

Entity type Code Description
polypeptide(L) P25440 BROMODOMAIN-CONTAINING PROTEIN 2
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

3AQA
Real-Time Imaging of Histone H4K12-Specific Acetylation Determines the Modes of Action of Histone Deacetylase and Bromodomain Inhibitors

Entity type Code Description
polypeptide(L) P25440 Bromodomain-containing protein 2
Ligand BYH 1-[2-(1H-BENZIMIDAZOL-2-YLSULFANYL)ETHYL]-3-METHYL-1,3-DIHYDRO-2H-BENZIMIDAZOLE-2-THIONE
Ligand MES 2-(N-MORPHOLINO)-ETHANESULFONIC ACID

4A9E
Fragment-Based Discovery of Bromodomain Inhibitors Part 1: Inhibitor Binding Modes and Implications for Lead Discovery.

Entity type Code Description
polypeptide(L) P25440 BROMODOMAIN-CONTAINING PROTEIN 2
Ligand 3PF 3-METHYL-3,4-DIHYDROQUINAZOLIN-2(1H)-ONE

4A9F
Fragment-Based Discovery of Bromodomain Inhibitors Part 1: Inhibitor Binding Modes and Implications for Lead Discovery.

Entity type Code Description
polypeptide(L) P25440 BROMODOMAIN-CONTAINING PROTEIN 2
Ligand MB3 1-METHYLPYRROLIDIN-2-ONE

4A9H
Fragment-Based Discovery of Bromodomain Inhibitors Part 1: Inhibitor Binding Modes and Implications for Lead Discovery.

Entity type Code Description
polypeptide(L) P25440 BROMODOMAIN-CONTAINING PROTEIN 2
Ligand TVP (2S)-1-ACETYL-2-METHYL-1,2,3,4-TETRAHYDROQUINOLINE

4A9I
Fragment-Based Discovery of Bromodomain Inhibitors Part 1: Inhibitor Binding Modes and Implications for Lead Discovery.

Entity type Code Description
polypeptide(L) P25440 BROMODOMAIN CONTAINING 2
Ligand P9I 1-[1-(PYRIDIN-2-YL)INDOLIZIN-3-YL]ETHAN-1-ONE

4A9J
Fragment-Based Discovery of Bromodomain Inhibitors Part 1: Inhibitor Binding Modes and Implications for Lead Discovery.

Entity type Code Description
polypeptide(L) P25440 BROMODOMAIN CONTAINING 2
Ligand TYL N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)

4A9M
Fragment-Based Discovery of Bromodomain Inhibitors Part 2: Optimization of Phenylisoxazole Sulfonamides.

Entity type Code Description
polypeptide(L) P25440 BROMODOMAIN CONTAINING 2
Ligand P9M N-CYCLOPENTYL-5-(3,5-DIMETHYLISOXAZOL-4-YL)-2-METHYLBENZENESULFONAMIDE

4A9N
Fragment-Based Discovery of Bromodomain Inhibitors Part 2: Optimization of Phenylisoxazole Sulfonamides.

Entity type Code Description
polypeptide(L) P25440 BROMODOMAIN CONTAINING 2
Ligand A9N N-CYCLOPROP-2-EN-1-YL-5-(3,5-DIMETHYL-1,2-OXAZOL-4-YL)-2-METHYL-BENZENESULFONAMIDE

4A9O
Fragment-Based Discovery of Bromodomain Inhibitors Part 2: Optimization of Phenylisoxazole Sulfonamides.

Entity type Code Description
polypeptide(L) P25440 BROMODOMAIN CONTAINING 2
Ligand A9O 5-ETHYL-3-METHYL-4-PHENYL-1,2-OXAZOLE

4AKN
Identification of a Novel Series of Bet Family Bromodomain Inhibitors: Binding Mode and Profile of I-Bet151 (Gsk1210151A).

Entity type Code Description
polypeptide(L) P25440 BROMODOMAIN-CONTAINING PROTEIN 2
Ligand S5B 4-[(2-TERT-BUTYLPHENYL)AMINO]-7-(3,5-DIMETHYL-1,2-OXAZOL-4-YL)QUINOLINE-3-CARBOXYLIC ACID

4ALG
Identification of a Novel Series of Bet Family Bromodomain Inhibitors: Binding Mode and Profile of I-Bet151 (Gsk1210151A).

Entity type Code Description
polypeptide(L) P25440 BROMODOMAIN-CONTAINING PROTEIN 2
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

4ALH
Fragment-Based Discovery of Bromodomain Inhibitors Part 2: Optimization of Phenylisoxazole Sulfonamides.

Entity type Code Description
polypeptide(L) P25440 BROMODOMAIN CONTAINING 2
Ligand A9P 3,5 DIMETHYL-4-PHENYL-1,2-OXAZOLE