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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'RNA-directed RNA polymerase' and Ligand = 'BDBM50176294'   
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
RNA-directed RNA polymerase


(Hepatitis C virus)
BDBM50176294
PNG
(CHEMBL373241 | ethyl 2-(3-(indolin-1-ylsulfonyl)ur...)
Show SMILES CCOC(=O)c1c(NC(=O)NS(=O)(=O)N2CCc3ccccc23)sc2CC(C)(C)CCc12
Show InChI InChI=1S/C22H27N3O5S2/c1-4-30-20(26)18-15-9-11-22(2,3)13-17(15)31-19(18)23-21(27)24-32(28,29)25-12-10-14-7-5-6-8-16(14)25/h5-8H,4,9-13H2,1-3H3,(H2,23,24,27)
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 200n/an/an/an/an/an/a



ViroPharma Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against HCV 4a NS5B full length RNA dependent RNA polymerase


Bioorg Med Chem Lett 16: 100-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.09.047
BindingDB Entry DOI: 10.7270/Q2M32VBT
More data for this
Ligand-Target Pair
RNA-directed RNA polymerase


(Hepatitis C virus)
BDBM50176294
PNG
(CHEMBL373241 | ethyl 2-(3-(indolin-1-ylsulfonyl)ur...)
Show SMILES CCOC(=O)c1c(NC(=O)NS(=O)(=O)N2CCc3ccccc23)sc2CC(C)(C)CCc12
Show InChI InChI=1S/C22H27N3O5S2/c1-4-30-20(26)18-15-9-11-22(2,3)13-17(15)31-19(18)23-21(27)24-32(28,29)25-12-10-14-7-5-6-8-16(14)25/h5-8H,4,9-13H2,1-3H3,(H2,23,24,27)
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 260n/an/an/an/an/an/a



ViroPharma Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against delta-21 C-terminally truncated HCV 1b (BB7 isolate) RNA dependent RNA polymerase


Bioorg Med Chem Lett 16: 100-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.09.047
BindingDB Entry DOI: 10.7270/Q2M32VBT
More data for this
Ligand-Target Pair