BDBM50414215 CHEMBL540756

SMILES: CC(C)(O)c1ccc2Nc3cc(Nc4ccncc4)ccc3C(=O)Nc2c1

InChI Key: InChIKey=WJRCSUVKRQODKT-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 = 50414215   

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))	BDBM50414215 (CHEMBL540756) Show SMILES CC(C)(O)c1ccc2Nc3cc(Nc4ccncc4)ccc3C(=O)Nc2c1 Show InChI InChI=1S/C21H20N4O2/c1-21(2,27)13-3-6-17-19(11-13)25-20(26)16-5-4-15(12-18(16)24-17)23-14-7-9-22-10-8-14/h3-12,24,27H,1-2H3,(H,22,23)(H,25,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	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