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Found 1 hit Enz. Inhib. hit(s) with Target = 'Cathepsin S' and Ligand = 'BDBM50463229'   
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 S


(Homo sapiens (Human))		BDBM50463229
PNG
(CHEMBL4243256)
Show SMILES FC(F)(F)Oc1ccc(Nc2nc(NC3CCNCC3)nc(n2)C#N)cc1
Show InChI InChI=1S/C16H16F3N7O/c17-16(18,19)27-12-3-1-10(2-4-12)22-14-24-13(9-20)25-15(26-14)23-11-5-7-21-8-6-11/h1-4,11,21H,5-8H2,(H2,22,23,24,25,26)
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Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human cathepsin S using Z-LR-AMC as substrate after 30 mins by spectrofluorimetric method

Bioorg Med Chem 26: 4310-4319 (2018)


Article DOI: 10.1016/j.bmc.2018.07.032
BindingDB Entry DOI: 10.7270/Q2P271RF
More data for this
Ligand-Target Pair