BDBM50414095 CHEMBL542007

SMILES: Nc1cc2OC\C=C\CCOc3cncc(NC(=O)Nc2cc1Cl)n3

InChI Key: InChIKey=DSUIEFJZFWCWOF-OWOJBTEDSA-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 = 50414095   

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))	BDBM50414095 (CHEMBL542007) Show SMILES Nc1cc2OC\C=C\CCOc3cncc(NC(=O)Nc2cc1Cl)n3 |t:6| Show InChI InChI=1S/C16H16ClN5O3/c17-10-6-12-13(7-11(10)18)24-4-2-1-3-5-25-15-9-19-8-14(21-15)22-16(23)20-12/h1-2,6-9H,3-5,18H2,(H2,20,21,22,23)/b2-1+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.60	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