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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cathepsin S' and Ligand = 'BDBM109847'   
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))
BDBM109847
PNG
(US8609681, 70)
Show SMILES FC(F)(C[C@H](NC(=O)N1CCC2(CC2)CC1)C(=O)NC1(CC1)C#N)Cc1ccccc1 |r|
Show InChI InChI=1S/C23H28F2N4O2/c24-23(25,14-17-4-2-1-3-5-17)15-18(19(30)28-22(16-26)8-9-22)27-20(31)29-12-10-21(6-7-21)11-13-29/h1-5,18H,6-15H2,(H,27,31)(H,28,30)/t18-/m0/s1
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MMDB

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US Patent
0.300n/an/an/an/an/an/an/an/a



Sanofi

US Patent


Assay Description
Determination of the enzymatic activity of the catalytic domain of human Cathepsin S. This protein is obtained as an inactive enzyme from R&D Systems...


US Patent US8609681 (2013)


BindingDB Entry DOI: 10.7270/Q2F47MSF
More data for this
Ligand-Target Pair