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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cathepsin L' and Monomerid = 50119060   
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))
BDBM50119060
PNG
(CHEMBL99288 | N-{(S)-1-[(S)-1-(2-Hydroxy-acetyl)-p...)
Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)c1cccc(c1)C(N)=O)C(C)CC)C(=O)CO
Show InChI InChI=1S/C21H31N3O5/c1-4-6-10-16(17(26)12-25)23-21(29)18(13(3)5-2)24-20(28)15-9-7-8-14(11-15)19(22)27/h7-9,11,13,16,18,25H,4-6,10,12H2,1-3H3,(H2,22,27)(H,23,29)(H,24,28)/t13?,16-,18-/m0/s1
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Similars

Article
PubMed
760n/an/an/an/an/an/an/an/a



Celera

Curated by ChEMBL


Assay Description
Binding affinity of compound was evaluated against cathepsin L.


Bioorg Med Chem Lett 12: 2887-91 (2002)


Article DOI: 10.1016/s0960-894x(02)00611-x
BindingDB Entry DOI: 10.7270/Q21V5D9F
More data for this
Ligand-Target Pair