BDBM50325165 5-methyl-8-(4-((methylamino)methyl)phenyl)-[1,2,4]triazolo[4,3-a]quinolin-1(2H)-one::CHEMBL1223388

SMILES: CNCc1ccc(cc1)-c1ccc2c(C)cc3n[nH]c(=O)n3c2c1

InChI Key: InChIKey=JGWGGEAYCCMUQO-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 = 50325165   

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))	BDBM50325165 (5-methyl-8-(4-((methylamino)methyl)phenyl)-[1,2,4]...) Show SMILES CNCc1ccc(cc1)-c1ccc2c(C)cc3n[nH]c(=O)n3c2c1 Show InChI InChI=1S/C19H18N4O/c1-12-9-18-21-22-19(24)23(18)17-10-15(7-8-16(12)17)14-5-3-13(4-6-14)11-20-2/h3-10,20H,11H2,1-2H3,(H,22,24)	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	40	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)