Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Procathepsin L' and Ligand = 'BDBM210869'   

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))	BDBM210869 (US9290467, 39) Show SMILES CC(C)(C)OC(=O)N1CC(C1)c1ccc2OC\C=C\COc3ccc(C[C@H](NC(=O)c2c1)C(=O)NC1(CC1)C#N)cc3Cl |r,t:18| Show InChI InChI=1S/C32H35ClN4O6/c1-31(2,3)43-30(40)37-17-22(18-37)21-7-9-26-23(16-21)28(38)35-25(29(39)36-32(19-34)10-11-32)15-20-6-8-27(24(33)14-20)42-13-5-4-12-41-26/h4-9,14,16,22,25H,10-13,15,17-18H2,1-3H3,(H,35,38)(H,36,39)/b5-4+/t25-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	26.2	n/a	n/a	n/a	n/a	6.5	n/a
HOFFMANN—LA ROCHE INC. US Patent					Assay Description Enzyme activity is measured by observing the increase in fluorescence intensity caused by cleavage of a peptide substrate containing a fluorophore wh...				US Patent US9290467 (2016) BindingDB Entry DOI: 10.7270/Q2H130VZ
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