Reaction Details Report a problem with these data
Target
RNA-directed RNA polymerase
Ligand
BDBM50142065
Substrate
n/a
Meas. Tech.
ChEBML_143775
IC50
400±n/a nM
Citation
Beaulieu, PL; Bös, M; Bousquet, Y; DeRoy, P; Fazal, G; Gauthier, J; Gillard, J; Goulet, S; McKercher, G; Poupart, MA; Valois, S; Kukolj, G Non-nucleoside inhibitors of the hepatitis C virus NS5B polymerase: discovery of benzimidazole 5-carboxylic amide derivatives with low-nanomolar potency. Bioorg Med Chem Lett 14:967-71 (2004) [PubMed] Article
More Info.:
Target
Name:
RNA-directed RNA polymerase
Synonyms:
Hepatitis C virus NS5B RNA-dependent RNA polymerase | NS5B protein
Type:
Protein
Mol. Mass.:
25173.95
Organism:
Hepatitis C virus
Description:
Q8JXU8
Residue:
229
Sequence:
RTEEAIYQCCDLDPQARVAIRSLTERLYVGGPLTNSRGENCGYRRRASGVLTTSCGNTLTCYIKAQAACRAAGRQDCTMLVCGDDLVVICESAGVQEDAASLRAFTEAMTRYSAPPGDPPQPEYDLELITSCSSNVSVAHDGAGKRVYYLTRDPTTPLARAAWETARHTPVNSWLGNIIMFAPTLWVRMIMLTHFFSVLIARDQLEQALDCEIYGACYSIEPLLPPIIQ
Inhibitor
Name:
BDBM50142065
Synonyms:
CHEMBL177283 | [(1-Cyclohexyl-2-furan-3-yl-1H-benzoimidazole-5-carbonyl)-amino]-((S)-3,4-dimethoxy-phenyl)-acetic acid
Type:
Small organic molecule
Emp. Form.:
C28H29N3O6
Mol. Mass.:
503.5464
SMILES:
COc1ccc(cc1OC)[C@H](NC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccoc1)C(O)=O