BDBM50414219 CHEMBL559621

SMILES: COc1cc-2c(Cc3c(n[nH]c-23)-c2ccccc2)cc1OCCCN1CCOCC1

InChI Key: InChIKey=GTBCQDGRKRXSFF-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 = 50414219   

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))	BDBM50414219 (CHEMBL559621) Show SMILES COc1cc-2c(Cc3c(n[nH]c-23)-c2ccccc2)cc1OCCCN1CCOCC1 Show InChI InChI=1S/C24H27N3O3/c1-28-21-16-19-18(15-22(21)30-11-5-8-27-9-12-29-13-10-27)14-20-23(25-26-24(19)20)17-6-3-2-4-7-17/h2-4,6-7,15-16H,5,8-14H2,1H3,(H,25,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.5	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