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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cathepsin L' and Monomerid = 50273256   
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))
BDBM50273256
PNG
(2-Cyano-4-[(spiro[2.5]oct-6-ylmethyl)-amino]-pyrim...)
Show SMILES O=C(N[C@@H](CN1CCCC1)Cc1ccccn1)c1cnc(nc1NCC1CCC2(CC2)CC1)C#N
Show InChI InChI=1/C27H35N7O/c28-16-24-30-18-23(25(33-24)31-17-20-6-8-27(9-7-20)10-11-27)26(35)32-22(19-34-13-3-4-14-34)15-21-5-1-2-12-29-21/h1-2,5,12,18,20,22H,3-4,6-11,13-15,17,19H2,(H,32,35)(H,30,31,33)/t22-/s2
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Article
PubMed
n/an/a 480n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Inhibition of human recombinant cathepsin L by fluorometric assay


Bioorg Med Chem Lett 18: 4642-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.011
BindingDB Entry DOI: 10.7270/Q2WH2PS6
More data for this
Ligand-Target Pair