Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Calpain small subunit 1' and Ligand = 'BDBM50124030'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Calpain small subunit 1 (Sus scrofa)	BDBM50124030 (1-(Toluene-4-sulfonyl)-azetidine-2-carboxylic acid...) Show SMILES Cc1ccc(cc1)S(=O)(=O)N1CCC1C(=O)NC(Cc1ccccc1)C=O Show InChI InChI=1S/C20H22N2O4S/c1-15-7-9-18(10-8-15)27(25,26)22-12-11-19(22)20(24)21-17(14-23)13-16-5-3-2-4-6-16/h2-10,14,17,19H,11-13H2,1H3,(H,21,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	250	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tennessee Health Science Center Curated by ChEMBL					Assay Description Compound tested for inhibition of porcine Calpain 1				Bioorg Med Chem Lett 13: 783-4 (2003) BindingDB Entry DOI: 10.7270/Q2PN950V
					More data for this Ligand-Target Pair