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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 = 'BDBM50176285'   
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)
BDBM50176285
PNG
(CHEMBL440391 | ethyl 6,6-dimethyl-2-(3-(pyridin-2-...)
Show SMILES CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2ccccn2)sc2CC(C)(C)CCc12
Show InChI InChI=1S/C19H23N3O5S2/c1-4-27-17(23)15-12-8-9-19(2,3)11-13(12)28-16(15)21-18(24)22-29(25,26)14-7-5-6-10-20-14/h5-7,10H,4,8-9,11H2,1-3H3,(H2,21,22,24)
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 40n/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)
BDBM50176285
PNG
(CHEMBL440391 | ethyl 6,6-dimethyl-2-(3-(pyridin-2-...)
Show SMILES CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2ccccn2)sc2CC(C)(C)CCc12
Show InChI InChI=1S/C19H23N3O5S2/c1-4-27-17(23)15-12-8-9-19(2,3)11-13(12)28-16(15)21-18(24)22-29(25,26)14-7-5-6-10-20-14/h5-7,10H,4,8-9,11H2,1-3H3,(H2,21,22,24)
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 150n/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