BDBM50170007 CHEMBL190363::[3H-Benzothiazol-(2Z)-ylidene]-[2-(2-p-tolyl-ethylamino)-pyrimidin-4-yl]-acetonitrile

SMILES: Cc1ccc(CCNc2nccc(n2)C(C#N)c2nc3ccccc3s2)cc1

InChI Key: InChIKey=PMIYFBBUZVIPPA-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 = 50170007   

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)	BDBM50170007 (CHEMBL190363 | [3H-Benzothiazol-(2Z)-ylidene]-[2-(...) Show SMILES Cc1ccc(CCNc2nccc(n2)C(C#N)c2nc3ccccc3s2)cc1 Show InChI InChI=1S/C22H19N5S/c1-15-6-8-16(9-7-15)10-12-24-22-25-13-11-18(27-22)17(14-23)21-26-19-4-2-3-5-20(19)28-21/h2-9,11,13,17H,10,12H2,1H3,(H,24,25,27)	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