Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Calpain-1 catalytic subunit' and Ligand = 'BDBM50249607'   

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))	BDBM50249607 (3-acetyl-5,8-dichloro-2-(2,4-dichlorophenylamino)q...) Show SMILES CC(=O)c1c(Nc2ccc(Cl)cc2Cl)nc2c(Cl)ccc(Cl)c2c1O Show InChI InChI=1S/C17H10Cl4N2O2/c1-7(24)13-16(25)14-9(19)3-4-10(20)15(14)23-17(13)22-12-5-2-8(18)6-11(12)21/h2-6H,1H3,(H2,22,23,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.17E+3	n/a	n/a	n/a	n/a	n/a	n/a
Ewha Womans University Curated by ChEMBL					Assay Description Inhibition of human erythrocytes mu-calpain by fluorometric assay using pep2 as substrate				J Med Chem 52: 3093-7 (2009) Article DOI: 10.1021/jm8014734 BindingDB Entry DOI: 10.7270/Q2KK9CQ4
					More data for this Ligand-Target Pair
Calpain-1 catalytic subunit (Homo sapiens (Human))	BDBM50249607 (3-acetyl-5,8-dichloro-2-(2,4-dichlorophenylamino)q...) Show SMILES CC(=O)c1c(Nc2ccc(Cl)cc2Cl)nc2c(Cl)ccc(Cl)c2c1O Show InChI InChI=1S/C17H10Cl4N2O2/c1-7(24)13-16(25)14-9(19)3-4-10(20)15(14)23-17(13)22-12-5-2-8(18)6-11(12)21/h2-6H,1H3,(H2,22,23,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.99E+3	n/a	n/a	n/a	n/a	n/a	n/a
Ewha Womans University Curated by ChEMBL					Assay Description Inhibition of human erythrocytes mu-calpain after 30 mins by fluorometric assay using pep1 as substrate				J Med Chem 52: 3093-7 (2009) Article DOI: 10.1021/jm8014734 BindingDB Entry DOI: 10.7270/Q2KK9CQ4
					More data for this Ligand-Target Pair