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Target
RNA-directed RNA polymerase
Ligand
BDBM50503940
Substrate
n/a
Meas. Tech.
ChEMBL_1812626 (CHEMBL4312200)
EC50
1.000000±n/a nM
Citation
 Liu, H; Dai, X; He, S; Brockunier, L; Marcantonio, K; Ludmerer, SW; Li, F; Feng, KI; Nargund, RP; Palani, A Design and evaluation of novel tetracyclic benzofurans as palm site allosteric inhibitors of HCV NS5B polymerase. Bioorg Med Chem Lett 29:0 (2019) [PubMed]  Article 
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:
BDBM50503940
Synonyms:
CHEMBL4435877
Type:
Small organic molecule
Emp. Form.:
C32H25F2N5O4S
Mol. Mass.:
613.634
SMILES:
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2NCn3c(cc4c(F)cccc34)-c2n1)-c1ccc(F)cc1
Structure:
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