Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Procathepsin L' and Ligand = 'BDBM50121301'   

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
Procathepsin L (Homo sapiens (Human))	BDBM50121301 (5-Amino-2-[2-(2-biphenyl-4-yl-acetylamino)-3-methy...) Show SMILES CSCC(NC(=O)Cc1ccc(cc1)-c1ccccc1)C(=O)N[C@H](CCCN)C(=O)NC(Cc1ccccc1)C(=O)NC(Cc1ccccc1)C(=O)NCCc1ccccc1 Show InChI InChI=1S/C49H56N6O5S/c1-61-34-44(52-45(56)33-38-24-26-40(27-25-38)39-21-12-5-13-22-39)49(60)53-41(23-14-29-50)47(58)55-43(32-37-19-10-4-11-20-37)48(59)54-42(31-36-17-8-3-9-18-36)46(57)51-30-28-35-15-6-2-7-16-35/h2-13,15-22,24-27,41-44H,14,23,28-34,50H2,1H3,(H,51,57)(H,52,56)(H,53,60)(H,54,59)(H,55,58)/t41-,42?,43?,44?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Research Council of Canada Curated by ChEMBL					Assay Description Inhibitory activity against human Cathepsin L				J Med Chem 45: 5321-9 (2002) BindingDB Entry DOI: 10.7270/Q23B5ZH6
					More data for this Ligand-Target Pair