Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Procathepsin L' and Ligand = 'BDBM19605'   

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))	BDBM19605 ((2S)-N-[(2S)-5-amino-1-(5-fluoro-2,3-dihydro-1H-in...) Show SMILES COc1cccc(c1)C(=O)N[C@@H](CCC1CCCCC1)C(=O)N[C@@H](CCCN)CN1CCc2cc(F)ccc12 |r| Show InChI InChI=1S/C31H43FN4O3/c1-39-27-11-5-9-24(20-27)30(37)35-28(14-12-22-7-3-2-4-8-22)31(38)34-26(10-6-17-33)21-36-18-16-23-19-25(32)13-15-29(23)36/h5,9,11,13,15,19-20,22,26,28H,2-4,6-8,10,12,14,16-18,21,33H2,1H3,(H,34,38)(H,35,37)/t26-,28-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	42	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GNF					Assay Description The recombinant human cathepsin enzyme was preincubated with inhibitor for 20 minutes prior to addition of substrate. The substrate hydrolysis was mo...				Bioorg Med Chem Lett 16: 1486-90 (2006) Article DOI: 10.1016/j.bmcl.2005.12.056 BindingDB Entry DOI: 10.7270/Q2TQ5ZTJ
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