BDBM50229106 CHEMBL403342::N-(2-cyanoethyl)-2-methyl-5-(2-(pyridin-2-ylamino)thiazol-5-ylthio)benzamide

SMILES: Cc1ccc(Sc2cnc(Nc3ccccn3)s2)cc1C(=O)NCCC#N

InChI Key: InChIKey=ZGXYSCDQVGNQKN-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 = 50229106   

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
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM50229106 (CHEMBL403342 | N-(2-cyanoethyl)-2-methyl-5-(2-(pyr...) Show SMILES Cc1ccc(Sc2cnc(Nc3ccccn3)s2)cc1C(=O)NCCC#N Show InChI InChI=1S/C19H17N5OS2/c1-13-6-7-14(11-15(13)18(25)22-10-4-8-20)26-17-12-23-19(27-17)24-16-5-2-3-9-21-16/h2-3,5-7,9,11-12H,4,10H2,1H3,(H,22,25)(H,21,23,24)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	65	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development Curated by ChEMBL					Assay Description Inhibition of TrkA				Bioorg Med Chem Lett 18: 634-9 (2008) Article DOI: 10.1016/j.bmcl.2007.11.076 BindingDB Entry DOI: 10.7270/Q2JD4WJ5
					More data for this Ligand-Target Pair