BDBM50325159 4-(5-methyl-1-oxo-1,2-dihydro-[1,2,4]triazolo[4,3-a]quinolin-8-yl)benzonitrile::CHEMBL1223318

SMILES: Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc(cc1)C#N

InChI Key: InChIKey=IKBUFWUQZVXXDF-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 = 50325159   

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))	BDBM50325159 (4-(5-methyl-1-oxo-1,2-dihydro-[1,2,4]triazolo[4,3-...) Show SMILES Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc(cc1)C#N Show InChI InChI=1S/C18H12N4O/c1-11-8-17-20-21-18(23)22(17)16-9-14(6-7-15(11)16)13-4-2-12(10-19)3-5-13/h2-9H,1H3,(H,21,23)	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	100	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca R&D Boston Curated by ChEMBL					Assay Description Inhibition of His6-CHK1 expressed in baculovirus infected Sf9 cells				Bioorg Med Chem Lett 20: 5133-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.015 BindingDB Entry DOI: 10.7270/Q2FF3SJZ
					More data for this Ligand-Target Pair				3D Structure (docked)