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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Procathepsin L' and Ligand = 'BDBM50121906'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Procathepsin L


(Homo sapiens (Human))
BDBM50121906
PNG
(CHEMBL31363 | [(S)-1-((2S,3S)-2-Isobutoxy-4-oxo-az...)
Show SMILES CC(C)CO[C@@H]1NC(=O)[C@H]1NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1
Show InChI InChI=1S/C24H29N3O5/c1-16(2)14-31-23-20(22(29)27-23)26-21(28)19(13-17-9-5-3-6-10-17)25-24(30)32-15-18-11-7-4-8-12-18/h3-12,16,19-20,23H,13-15H2,1-2H3,(H,25,30)(H,26,28)(H,27,29)/t19-,20+,23-/m0/s1
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MMDB

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n/an/a 91n/an/an/an/an/an/a



currently NAEJA Pharmaceutical Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human Cathepsin L


Bioorg Med Chem Lett 13: 139-41 (2002)


BindingDB Entry DOI: 10.7270/Q27W6BJB
More data for this
Ligand-Target Pair