Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Calpain-1 catalytic subunit' and Ligand = 'BDBM50227403'   

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))	BDBM50227403 ((S)-N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-met...) Show SMILES Cc1c(O)c2ccccc2nc1C(=O)N[C@@H](Cc1ccccc1)C(=O)C(N)=O |r| Show InChI InChI=1S/C21H19N3O4/c1-12-17(23-15-10-6-5-9-14(15)18(12)25)21(28)24-16(19(26)20(22)27)11-13-7-3-2-4-8-13/h2-10,16H,11H2,1H3,(H2,22,27)(H,23,25)(H,24,28)/t16-/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	710	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human erythrocytes mu-calpain				Bioorg Med Chem Lett 19: 502-7 (2008) Article DOI: 10.1016/j.bmcl.2008.11.030 BindingDB Entry DOI: 10.7270/Q2PK0H2S
					More data for this Ligand-Target Pair
Calpain-1 catalytic subunit (Homo sapiens (Human))	BDBM50227403 ((S)-N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-met...) Show SMILES Cc1c(O)c2ccccc2nc1C(=O)N[C@@H](Cc1ccccc1)C(=O)C(N)=O |r| Show InChI InChI=1S/C21H19N3O4/c1-12-17(23-15-10-6-5-9-14(15)18(12)25)21(28)24-16(19(26)20(22)27)11-13-7-3-2-4-8-13/h2-10,16H,11H2,1H3,(H2,22,27)(H,23,25)(H,24,28)/t16-/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	710	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