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BDBM183601 US9145354, 258

SMILES: CCC[C@@H](N[C@@H](C)CC(N)=O)c1ccc(Cl)c(C(=O)c2ccc(N)nc2)c1F

InChI Key: InChIKey=PDRMLAXRIBKSOE-XHDPSFHLSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 183601   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
HCV NS3-NS4A Serine Proteinase


(Hepatitis C virus (HCV genotype 1a, isolate H))
BDBM183601
PNG
(US9145354, 258)
Show SMILES CCC[C@@H](N[C@@H](C)CC(N)=O)c1ccc(Cl)c(C(=O)c2ccc(N)nc2)c1F
Show InChI InChI=1S/C20H24ClFN4O2/c1-3-4-15(26-11(2)9-17(24)27)13-6-7-14(21)18(19(13)22)20(28)12-5-8-16(23)25-10-12/h5-8,10-11,15,26H,3-4,9H2,1-2H3,(H2,23,25)(H2,24,27)/t11-,15+/m0/s1
PDB
MMDB

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Similars

US Patent
n/an/a 280n/an/an/an/an/a25



Astex Therapeutics Limited

US Patent


Assay Description
The HCV NS3 protease functions have been extensively studied and are considered as potential targets for antiviral therapy: see for example the many ...


US Patent US9145354 (2015)


BindingDB Entry DOI: 10.7270/Q2VH5MMZ
More data for this
Ligand-Target Pair