Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Calpain-1 catalytic subunit' and Ligand = 'BDBM50227396'   

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))	BDBM50227396 ((S)-N-(4-(ethylamino)-3,4-dioxo-1-phenylbutan-2-yl...) Show SMILES CCNC(=O)C(=O)[C@H](Cc1ccccc1)NC(=O)c1nc2ccccc2c(O)c1C Show InChI InChI=1S/C23H23N3O4/c1-3-24-23(30)21(28)18(13-15-9-5-4-6-10-15)26-22(29)19-14(2)20(27)16-11-7-8-12-17(16)25-19/h4-12,18H,3,13H2,1-2H3,(H,24,30)(H,25,27)(H,26,29)/t18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.02E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kyung Hee University Curated by ChEMBL					Assay Description Inhibition of human mu-calpain				Bioorg Med Chem Lett 18: 205-9 (2008) Article DOI: 10.1016/j.bmcl.2007.10.097 BindingDB Entry DOI: 10.7270/Q2CV4HH3
					More data for this Ligand-Target Pair