BDBM50414086 CHEMBL563792

SMILES: CCc1cc-2c(Cc3c(n[nH]c-23)-c2cccnc2)cc1OC1CCOC1

InChI Key: InChIKey=VSPPNECXPLDRSL-UHFFFAOYSA-N

Data: 1 KI

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 = 50414086   

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))	BDBM50414086 (CHEMBL563792) Show SMILES CCc1cc-2c(Cc3c(n[nH]c-23)-c2cccnc2)cc1OC1CCOC1 Show InChI InChI=1S/C21H21N3O2/c1-2-13-8-17-15(10-19(13)26-16-5-7-25-12-16)9-18-20(23-24-21(17)18)14-4-3-6-22-11-14/h3-4,6,8,10-11,16H,2,5,7,9,12H2,1H3,(H,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of Chk1				J Med Chem 52: 3159-65 (2009) Article DOI: 10.1021/jm801444x BindingDB Entry DOI: 10.7270/Q2FF3TM8
					More data for this Ligand-Target Pair