BDBM50251046 CHEMBL4060565

SMILES: COc1cccc(c1)-c1nc2sc3CN(Cc4ccccc4)CCc3c2c(=O)[nH]1

InChI Key: InChIKey=WZQCGXDCZUHNJC-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50251046   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50251046 (CHEMBL4060565) Show SMILES COc1cccc(c1)-c1nc2sc3CN(Cc4ccccc4)CCc3c2c(=O)[nH]1 Show InChI InChI=1S/C23H21N3O2S/c1-28-17-9-5-8-16(12-17)21-24-22(27)20-18-10-11-26(13-15-6-3-2-4-7-15)14-19(18)29-23(20)25-21/h2-9,12H,10-11,13-14H2,1H3,(H,24,25,27)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sichuan University Curated by ChEMBL					Assay Description Inhibition of His/thioredoxin-tagged human recombinant BRD4 bromodomain-1 (43 to 166 residues) expressed in Escherichia coli BL21 Star (DE3) pre-incu...				J Med Chem 60: 9990-10012 (2017) Article DOI: 10.1021/acs.jmedchem.7b00275 BindingDB Entry DOI: 10.7270/Q2M32Z68
					More data for this Ligand-Target Pair