BDBM50170003 (2Z)-(2-chloropyrimidin-4-yl)(3-methyl-1,3-benzothiazol-2(3H)-ylidene)acetonitrile::CHEMBL189931

SMILES: CN1\C(Sc2ccccc12)=C(\C#N)c1ccnc(Cl)n1

InChI Key: InChIKey=PIYXPSVUEHFFRH-UKTHLTGXSA-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 = 50170003   

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
c-Jun N-terminal kinase 3 (Rattus norvegicus)	BDBM50170003 ((2Z)-(2-chloropyrimidin-4-yl)(3-methyl-1,3-benzoth...) Show SMILES CN1\C(Sc2ccccc12)=C(\C#N)c1ccnc(Cl)n1 Show InChI InChI=1S/C14H9ClN4S/c1-19-11-4-2-3-5-12(11)20-13(19)9(8-16)10-6-7-17-14(15)18-10/h2-7H,1H3/b13-9+	PDB MMDB KEGG B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Serono Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of rat c-Jun N-terminal kinase 3				J Med Chem 48: 4596-607 (2005) Article DOI: 10.1021/jm0310986 BindingDB Entry DOI: 10.7270/Q2K9389G
					More data for this Ligand-Target Pair