Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cathepsin D' and Ligand = 'BDBM50441657'   

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
Cathepsin D (Homo sapiens (Human))	BDBM50441657 (CHEMBL2437491) Show SMILES CC1(C)SCN(C1C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)C(=O)[C@@H](O)[C@H](Cc1ccccc1)NC(=O)COc1ccccc1 |r| Show InChI InChI=1S/C33H37N3O6S/c1-33(2)30(31(40)35-28-24-16-10-9-13-22(24)18-26(28)37)36(20-43-33)32(41)29(39)25(17-21-11-5-3-6-12-21)34-27(38)19-42-23-14-7-4-8-15-23/h3-16,25-26,28-30,37,39H,17-20H2,1-2H3,(H,34,38)(H,35,40)/t25-,26+,28-,29-,30?/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	142	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for Biomedical Research Curated by ChEMBL					Assay Description Inhibition of cathepsin D (unknown origin)				Bioorg Med Chem Lett 23: 5992-6000 (2013) Article DOI: 10.1016/j.bmcl.2013.08.030 BindingDB Entry DOI: 10.7270/Q21C1ZB5
					More data for this Ligand-Target Pair