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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cathepsin L1' and Ligand = 'BDBM50175213'   
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
Cathepsin L1


(Homo sapiens (Human))
BDBM50175213
PNG
((2S,3S)-dibenzyl 1-((S)-2-(tert-butoxycarbonyl)-2-...)
Show SMILES CC(C)(C)OC(=O)N[C@@H](N1CCCCC1)C(=O)N1[C@@H]([C@H]1C(=O)OCc1ccccc1)C(=O)OCc1ccccc1
Show InChI InChI=1S/C30H37N3O7/c1-30(2,3)40-29(37)31-25(32-17-11-6-12-18-32)26(34)33-23(27(35)38-19-21-13-7-4-8-14-21)24(33)28(36)39-20-22-15-9-5-10-16-22/h4-5,7-10,13-16,23-25H,6,11-12,17-20H2,1-3H3,(H,31,37)/t23-,24-,25-/m0/s1
PDB
MMDB

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PC cid
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Article
PubMed
6.40E+3n/an/an/an/an/an/an/an/a



University of Würzburg

Curated by ChEMBL


Assay Description
Inhibitory activity against cathepsin L


Bioorg Med Chem Lett 15: 5365-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.09.012
BindingDB Entry DOI: 10.7270/Q2XP74HX
More data for this
Ligand-Target Pair