BDBM50142043 (2S)-3-(5-(carboxymethoxy)-1H-indol-3-yl)-2-(1-cyclohexyl-2-(furan-3-yl)-1H-benzo[d]imidazole-5-carboxamido)propanoic acid::(S)-3-(5-(carboxymethoxy)-1H-indol-3-yl)-2-(1-cyclohexyl-2-(furan-3-yl)-1H-benzo[d]imidazole-5-carboxamido)propanoic acid::(S)-3-(5-Carboxymethoxy-1H-indol-3-yl)-2-[(1-cyclohexyl-2-furan-3-yl-1H-benzoimidazole-5-carbonyl)-amino]-propionic acid::CHEMBL366574
SMILES: OC(=O)COc1ccc2[nH]cc(C[C@H](NC(=O)c3ccc4n(C5CCCCC5)c(nc4c3)-c3ccoc3)C(O)=O)c2c1
InChI Key: InChIKey=ISZHARSXKHHLKL-SANMLTNESA-N
Data: 3 IC50
Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Hepatitis C virus NS5B RNA-dependent RNA polymerase (Hepatitis C virus) | BDBM50142043 ((2S)-3-(5-(carboxymethoxy)-1H-indol-3-yl)-2-(1-cyc...) | UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 19 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL | Assay Description Concentration required for inhibiting hepatitis C virus NS5B RNA polymerase activity. | Bioorg Med Chem Lett 14: 967-71 (2004) Article DOI: 10.1016/j.bmcl.2003.12.032 BindingDB Entry DOI: 10.7270/Q29C6WVF | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Bacterial DNA-directed RNA polymerase (Escherichia coli) | BDBM50142043 ((2S)-3-(5-(carboxymethoxy)-1H-indol-3-yl)-2-(1-cyc...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL | Assay Description Concentration required to inhibit DNA dependent RNA polymerase was determined from calf thymus | Bioorg Med Chem Lett 14: 967-71 (2004) Article DOI: 10.1016/j.bmcl.2003.12.032 BindingDB Entry DOI: 10.7270/Q29C6WVF | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
RNA polymerase subunit beta (β-RNAP) (Escherichia coli) | BDBM50142043 ((2S)-3-(5-(carboxymethoxy)-1H-indol-3-yl)-2-(1-cyc...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | >2.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL | Assay Description Concentration required to inhibit DNA dependent RNA polymerase was determined from calf thymus | Bioorg Med Chem Lett 14: 967-71 (2004) Article DOI: 10.1016/j.bmcl.2003.12.032 BindingDB Entry DOI: 10.7270/Q29C6WVF | |||||||||||
More data for this Ligand-Target Pair |