BDBM50218702 3-(3-methoxy-4-nitrophenyl)-5-methyl-5H-dibenzo[b,e][1,4]-diazepin-11(10H)-one::CHEMBL245209

SMILES: COc1cc(ccc1N)-c1ccc2c(c1)N(C)c1ccccc1NC2=O

InChI Key: InChIKey=CTGKQNCEQNFDCE-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 = 50218702   

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))	BDBM50218702 (3-(3-methoxy-4-nitrophenyl)-5-methyl-5H-dibenzo[b,...) Show SMILES COc1cc(ccc1N)-c1ccc2c(c1)N(C)c1ccccc1NC2=O Show InChI InChI=1S/C21H19N3O2/c1-24-18-6-4-3-5-17(18)23-21(25)15-9-7-13(11-19(15)24)14-8-10-16(22)20(12-14)26-2/h3-12H,22H2,1-2H3,(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	1.64E+3	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