BDBM50251019 CHEMBL4086588

SMILES: CCCc1cc2c(nc(Cc3ccc(cc3)-c3ccccc3)[nH]c2=O)s1

InChI Key: InChIKey=YCGPTWMVPFCYBZ-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 = 50251019   

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))	BDBM50251019 (CHEMBL4086588) Show SMILES CCCc1cc2c(nc(Cc3ccc(cc3)-c3ccccc3)[nH]c2=O)s1 Show InChI InChI=1S/C22H20N2OS/c1-2-6-18-14-19-21(25)23-20(24-22(19)26-18)13-15-9-11-17(12-10-15)16-7-4-3-5-8-16/h3-5,7-12,14H,2,6,13H2,1H3,(H,23,24,25)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	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