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BDBM50191520 2-[4-(biphenyl-2-ylmethoxy)-2-methoxyphenyl]-1-cyclohexyl-1H-benzoimidazole-5-carboxylic acid::CHEMBL212226

SMILES: COc1cc(OCc2ccccc2-c2ccccc2)ccc1-c1nc2cc(ccc2n1C1CCCCC1)C(O)=O

InChI Key: InChIKey=ZVULSSSMANUZDD-UHFFFAOYSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50191520   
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
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50191520
PNG
(2-[4-(biphenyl-2-ylmethoxy)-2-methoxyphenyl]-1-cyc...)
Show SMILES COc1cc(OCc2ccccc2-c2ccccc2)ccc1-c1nc2cc(ccc2n1C1CCCCC1)C(O)=O
Show InChI InChI=1S/C34H32N2O4/c1-39-32-21-27(40-22-25-12-8-9-15-28(25)23-10-4-2-5-11-23)17-18-29(32)33-35-30-20-24(34(37)38)16-19-31(30)36(33)26-13-6-3-7-14-26/h2,4-5,8-12,15-21,26H,3,6-7,13-14,22H2,1H3,(H,37,38)
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.10E+3n/an/an/an/an/an/a



Central Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of HCV 1b BK six His-tagged C-terminal truncated 544 amino acid NS5B RNA dependent RNA polymerase


J Med Chem 49: 4721-36 (2006)


Article DOI: 10.1021/jm060269e
BindingDB Entry DOI: 10.7270/Q2FN15TD
More data for this
Ligand-Target Pair
RNA-directed RNA polymerase


(Hepatitis C virus genotype 1)
BDBM50191520
PNG
(2-[4-(biphenyl-2-ylmethoxy)-2-methoxyphenyl]-1-cyc...)
Show SMILES COc1cc(OCc2ccccc2-c2ccccc2)ccc1-c1nc2cc(ccc2n1C1CCCCC1)C(O)=O
Show InChI InChI=1S/C34H32N2O4/c1-39-32-21-27(40-22-25-12-8-9-15-28(25)23-10-4-2-5-11-23)17-18-29(32)33-35-30-20-24(34(37)38)16-19-31(30)36(33)26-13-6-3-7-14-26/h2,4-5,8-12,15-21,26H,3,6-7,13-14,22H2,1H3,(H,37,38)
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 9.10E+5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Hepatitis C virus genotype 1 NS5B polymerases lacking C-terminal 47 amino acid residues expressed in Escherichia coli after 60 min


Citation and Details

Article DOI: 10.1007/s00044-012-0186-8
BindingDB Entry DOI: 10.7270/Q2NC6441
More data for this
Ligand-Target Pair
RNA-directed RNA polymerase


(Hepatitis C virus genotype 1)
BDBM50191520
PNG
(2-[4-(biphenyl-2-ylmethoxy)-2-methoxyphenyl]-1-cyc...)
Show SMILES COc1cc(OCc2ccccc2-c2ccccc2)ccc1-c1nc2cc(ccc2n1C1CCCCC1)C(O)=O
Show InChI InChI=1S/C34H32N2O4/c1-39-32-21-27(40-22-25-12-8-9-15-28(25)23-10-4-2-5-11-23)17-18-29(32)33-35-30-20-24(34(37)38)16-19-31(30)36(33)26-13-6-3-7-14-26/h2,4-5,8-12,15-21,26H,3,6-7,13-14,22H2,1H3,(H,37,38)
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 1.10E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Hepatitis C virus genotype 1 NS5B polymerases lacking C-terminal 47 amino acid residues expressed in Escherichia coli after 60 min


Citation and Details

Article DOI: 10.1007/s00044-012-0186-8
BindingDB Entry DOI: 10.7270/Q2NC6441
More data for this
Ligand-Target Pair