Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cathepsin D' and Ligand = 'BDBM50506521'   

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))	BDBM50506521 (CHEMBL4558691) Show SMILES O[C@H]1CC(=O)N[C@@H](Cc2cccnc2)C(=O)NCCCCCCCCCCCC(=O)N[C@H]1Cc1ccccc1 |r| Show InChI InChI=1S/C31H44N4O4/c36-28-22-30(38)35-27(21-25-16-13-18-32-23-25)31(39)33-19-12-7-5-3-1-2-4-6-11-17-29(37)34-26(28)20-24-14-9-8-10-15-24/h8-10,13-16,18,23,26-28,36H,1-7,11-12,17,19-22H2,(H,33,39)(H,34,37)(H,35,38)/t26-,27-,28-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.10	n/a	n/a	n/a	n/a	n/a	n/a
Czech Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of human placenta CatD using Abz-Lys-Pro-Ala-Glu-Phe-Nph-Ala-Leu as substrate preincubated for 10 mins followed by substrate addition and ...				J Med Chem 63: 1576-1596 (2020) Article DOI: 10.1021/acs.jmedchem.9b01351 BindingDB Entry DOI: 10.7270/Q24Q7Z8X
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