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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Genome polyprotein' and Ligand = 'BDBM50145835'   
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
Genome polyprotein


(Hepatitis C virus)
BDBM50145835
PNG
(4-Hydroxy-3,5-diiodo-benzoic acid | CHEMBL83650)
Show SMILES OC(=O)c1cc(I)c(O)c(I)c1
Show InChI InChI=1S/C7H4I2O3/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2,10H,(H,11,12)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
UniChem

Patents

Article
PubMed
6.00E+5n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Inhibition constant for HCV NS3 protease substrate binding site


J Med Chem 47: 2486-98 (2004)


Article DOI: 10.1021/jm0305117
BindingDB Entry DOI: 10.7270/Q2FF3RSP
More data for this
Ligand-Target Pair
Genome polyprotein


(Hepatitis C virus)
BDBM50145835
PNG
(4-Hydroxy-3,5-diiodo-benzoic acid | CHEMBL83650)
Show SMILES OC(=O)c1cc(I)c(O)c(I)c1
Show InChI InChI=1S/C7H4I2O3/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2,10H,(H,11,12)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/an/a 4.20E+5n/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Dissociation constant for HCV NS3 protease substrate binding site


J Med Chem 47: 2486-98 (2004)


Article DOI: 10.1021/jm0305117
BindingDB Entry DOI: 10.7270/Q2FF3RSP
More data for this
Ligand-Target Pair