BDBM50251037 CHEMBL4066449

SMILES: CC1CCc2c(C1)sc1nc([nH]c(=O)c21)-c1ccc(O)cc1

InChI Key: InChIKey=TZWSGFZJLUMAJN-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 = 50251037   

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))	BDBM50251037 (CHEMBL4066449) Show SMILES CC1CCc2c(C1)sc1nc([nH]c(=O)c21)-c1ccc(O)cc1 Show InChI InChI=1S/C17H16N2O2S/c1-9-2-7-12-13(8-9)22-17-14(12)16(21)18-15(19-17)10-3-5-11(20)6-4-10/h3-6,9,20H,2,7-8H2,1H3,(H,18,19,21)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.31E+3	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