Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Calpain-1 catalytic subunit' and Ligand = 'BDBM50092302'   

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-1 catalytic subunit (Homo sapiens (Human))	BDBM50092302 (1-(Naphthalene-2-sulfonyl)-piperidine-4-carboxylic...) Show SMILES O=C(NC(Cc1ccccc1)C(=O)C(=O)NCCCN1CCOCC1)C1CCN(CC1)S(=O)(=O)c1ccc2ccccc2c1 Show InChI InChI=1S/C33H40N4O6S/c38-31(33(40)34-15-6-16-36-19-21-43-22-20-36)30(23-25-7-2-1-3-8-25)35-32(39)27-13-17-37(18-14-27)44(41,42)29-12-11-26-9-4-5-10-28(26)24-29/h1-5,7-12,24,27,30H,6,13-23H2,(H,34,40)(H,35,39)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	810	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
KNOLL AG Curated by ChEMBL					Assay Description Inhibition of Suc-Leu-Tyr-AMC binding to human mu-calpain from erythrocytes				Bioorg Med Chem Lett 10: 2187-91 (2001) BindingDB Entry DOI: 10.7270/Q28K78BD
					More data for this Ligand-Target Pair