Reaction Details Report a problem with these data
Target
RNA-directed RNA polymerase
Ligand
BDBM50181954
Substrate
n/a
Meas. Tech.
ChEMBL_347313 (CHEMBL865646)
IC50
1.7±n/a nM
Citation
Evans, KA; Chai, D; Graybill, TL; Burton, G; Sarisky, RT; Lin-Goerke, J; Johnston, VK; Rivero, RA An efficient, asymmetric solid-phase synthesis of benzothiadiazine-substituted tetramic acids: potent inhibitors of the hepatitis C virus RNA-dependent RNA polymerase. Bioorg Med Chem Lett 16:2205-8 (2006) [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:
BDBM50181954
Synonyms:
(S)-5-tert-butyl-1-(3,3-dimethyl-butyl)-3-(1,1-dioxo-1,4-dihydro-1-benzo[1,2,4]thiadiazin-3-yl)-4-hydroxy-1,5-dihydro-pyrrol-2-one | CHEMBL204350
Type:
Small organic molecule
Emp. Form.:
C21H29N3O4S
Mol. Mass.:
419.538
SMILES:
CC(C)(C)CCN1[C@H](C(=O)C(C1=O)C1=Nc2ccccc2S(=O)(=O)N1)C(C)(C)C |t:14|