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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Bromodomain-containing protein 4' and Ligand = 'BDBM50465548'   
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))		BDBM50465548
PNG
(CHEMBL4286686)
Show SMILES CCn1cnc2n(Cc3ccc(CNS(=O)(=O)c4cc(ccc4C)-c4ccno4)cc3)c(=O)[nH]c(=O)c12
Show InChI InChI=1S/C25H24N6O5S/c1-3-30-15-26-23-22(30)24(32)29-25(33)31(23)14-18-7-5-17(6-8-18)13-28-37(34,35)21-12-19(9-4-16(21)2)20-10-11-27-36-20/h4-12,15,28H,3,13-14H2,1-2H3,(H,29,32,33)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.26E+3n/an/an/an/an/an/a



Aix-Marseille University

Curated by ChEMBL


Assay Description
Inhibition of TEV cleavage site-fused-GST tagged BRD4(BD1) (unknown origin) using SGRGK(Ac)CGK(Ac)-GLGK(Ac)GGAK(Ac)RHRKVG-peptide after 3 hrs by HTRF...

J Med Chem 61: 5719-5732 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00653
BindingDB Entry DOI: 10.7270/Q2Q52S95
More data for this
Ligand-Target Pair