BDBM50218713 9-hydroxy-3-(3-methoxy-4-nitrophenyl)-5H-dibenzo[b,e][1,4]-diazepin-11(10H)-one::CHEMBL243490

SMILES: COc1cc(ccc1N)-c1ccc2c(Nc3cccc(O)c3NC2=O)c1

InChI Key: InChIKey=KZZAZPKCUJYQOG-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 = 50218713   

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
Serine/threonine-protein kinase Chk1 (Homo sapiens (Human))	BDBM50218713 (9-hydroxy-3-(3-methoxy-4-nitrophenyl)-5H-dibenzo[b...) Show SMILES COc1cc(ccc1N)-c1ccc2c(Nc3cccc(O)c3NC2=O)c1 Show InChI InChI=1S/C20H17N3O3/c1-26-18-10-12(6-8-14(18)21)11-5-7-13-16(9-11)22-15-3-2-4-17(24)19(15)23-20(13)25/h2-10,22,24H,21H2,1H3,(H,23,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	72	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of human recombinant Chk1				J Med Chem 50: 4162-76 (2007) Article DOI: 10.1021/jm070105d BindingDB Entry DOI: 10.7270/Q22J6BKS
					More data for this Ligand-Target Pair