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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Bromodomain-containing protein 4' and Ligand = 'BDBM50463899'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463899
PNG
(CHEMBL4246969)
Show SMILES Cc1noc(C)c1-c1ccc(=O)n(Cc2ccc(cc2)C2CO2)c1
Show InChI InChI=1S/C19H18N2O3/c1-12-19(13(2)24-20-12)16-7-8-18(22)21(10-16)9-14-3-5-15(6-4-14)17-11-23-17/h3-8,10,17H,9,11H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
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MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 160n/an/an/an/an/an/a



Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD2) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-screen ...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463899
PNG
(CHEMBL4246969)
Show SMILES Cc1noc(C)c1-c1ccc(=O)n(Cc2ccc(cc2)C2CO2)c1
Show InChI InChI=1S/C19H18N2O3/c1-12-19(13(2)24-20-12)16-7-8-18(22)21(10-16)9-14-3-5-15(6-4-14)17-11-23-17/h3-8,10,17H,9,11H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 470n/an/an/an/an/an/a



Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD1/BD2) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-scr...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463899
PNG
(CHEMBL4246969)
Show SMILES Cc1noc(C)c1-c1ccc(=O)n(Cc2ccc(cc2)C2CO2)c1
Show InChI InChI=1S/C19H18N2O3/c1-12-19(13(2)24-20-12)16-7-8-18(22)21(10-16)9-14-3-5-15(6-4-14)17-11-23-17/h3-8,10,17H,9,11H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 480n/an/an/an/an/an/a



Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD1) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-screen ...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair