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Assay Detail

CHEMBL4183550

Review assay metadata, readout intent, target linkage, and publication context from the same page.

Binding
Inhibition of NS5A in HuH7 cell infected HCV genotype 1a H77 assessed as decrease in viral replication after 3 days by luciferase reporter gene assay
25
Total Activities
25
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Hepatitis C virus (isolate H77)
Confidence 8 — Homologous single protein target
Curated By Intermediate

Target

Nonstructural protein 5A (CHEMBL3307224)
Type SINGLE PROTEIN
Organism Hepatitis C virus

Publication

Highlights of the Structure-Activity Relationships of Benzimidazole Linked Pyrrolidines Leading to the Discovery of the Hepatitis C Virus NS5A Inhibitor Pibrentasvir (ABT-530).
Wagner R, Randolph JT, Patel SV, Nelson L, Matulenko MA, Keddy R, Pratt JK, Liu D, Krueger AC, Donner PL, Hutchinson DK, Flentge C, Betebenner D, Rockway T, Maring CJ, Ng TI, Krishnan P, Pilot-Matias T, Collins C, Panchal N, Reisch T, Dekhtyar T, Mondal R, Stolarik DF, Gao Y, Gao W, Beno DA, Kati WM.
J Med Chem (2018) 61 : 4052 -4066
PubMed 29653491 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
EC50 25 10.29 10.92

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4203054 1 10.92
CHEMBL4203574 1 10.92
CHEMBL3127326 OMBITASVIR 4.0 1 10.85
CHEMBL4208073 1 10.74
CHEMBL4211348 1 10.72
CHEMBL4203254 1 10.42
CHEMBL4215679 1 10.15
CHEMBL3127327 1 9.87
CHEMBL4202982 1 9.72
CHEMBL4208591 1 9.49
CHEMBL4206465 1 9.42
CHEMBL4215187 1 -
CHEMBL4205352 1 -
CHEMBL4210254 1 -
CHEMBL4218872 1 -
CHEMBL3960757 1 -
CHEMBL4211486 1 -
CHEMBL4215241 1 -
CHEMBL4204257 1 -
CHEMBL4215254 1 -
CHEMBL4202479 1 -
CHEMBL4215923 1 -
CHEMBL4203712 1 -
CHEMBL3545123 PIBRENTASVIR 4.0 1 -
CHEMBL3915742 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4203054 EC50 = 0.012 nM 10.92
CHEMBL4203574 EC50 = 0.012 nM 10.92
CHEMBL3127326 OMBITASVIR EC50 = 0.014 nM 10.85
CHEMBL4208073 EC50 = 0.018 nM 10.74
CHEMBL4211348 EC50 = 0.019 nM 10.72
CHEMBL4203254 EC50 = 0.038 nM 10.42
CHEMBL4215679 EC50 = 0.071 nM 10.15
CHEMBL3127327 EC50 = 0.136 nM 9.87
CHEMBL4202982 EC50 = 0.189 nM 9.72
CHEMBL4208591 EC50 = 0.324 nM 9.49
CHEMBL4206465 EC50 = 0.379 nM 9.42
CHEMBL4215187 EC50 = 0.003 nM -
CHEMBL4205352 EC50 = 0.001 nM -
CHEMBL4210254 EC50 = 0.004 nM -
CHEMBL4218872 EC50 = 0.001 nM -
CHEMBL3960757 EC50 = 0.009 nM -
CHEMBL4211486 EC50 = 0.002 nM -
CHEMBL4215241 EC50 = 0.006 nM -
CHEMBL4204257 EC50 = 0.003 nM -
CHEMBL4215254 EC50 = 0.004 nM -
CHEMBL4202479 EC50 = 0.004 nM -
CHEMBL4215923 EC50 = 0.002 nM -
CHEMBL4203712 EC50 = 0.005 nM -
CHEMBL3545123 PIBRENTASVIR EC50 = 0.0018 nM -
CHEMBL3915742 EC50 = 0.005 nM -