BDBM50218348 CHEMBL235972::N1-[5-(4-amino-5-sulfanyl-4H-1,2,4-triazol-3-yl)-4-phenyl-2-thienyl]acetamide

SMILES: CC(=O)Nc1cc(c(s1)-c1n[nH]c(=S)n1N)-c1ccccc1

InChI Key: InChIKey=JLKHGQLTVZHANW-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 = 50218348   

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
Cyclin-Dependent Kinase 5 (CDK5) (Homo sapiens (Human))	BDBM50218348 (CHEMBL235972 | N1-[5-(4-amino-5-sulfanyl-4H-1,2,4-...) Show SMILES CC(=O)Nc1cc(c(s1)-c1n[nH]c(=S)n1N)-c1ccccc1 Show InChI InChI=1S/C14H13N5OS2/c1-8(20)16-11-7-10(9-5-3-2-4-6-9)12(22-11)13-17-18-14(21)19(13)15/h2-7H,15H2,1H3,(H,16,20)(H,18,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	54	n/a	n/a	n/a	n/a	n/a	n/a
Dr. Reddy's Laboratories Curated by ChEMBL					Assay Description Inhibitory activity against Cdk5/p25				Bioorg Med Chem 15: 6397-406 (2007) Article DOI: 10.1016/j.bmc.2007.06.053 BindingDB Entry DOI: 10.7270/Q2JS9RP0
					More data for this Ligand-Target Pair