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Assay Detail

CHEMBL880598

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

Binding
Inhibitory concentration against NS5B HCV polymerase using [alpha-32P]UTP as radioligand (30 degree C for 2 h, at pH 7.5 with Tris-HCl buffer)
67
Total Activities
67
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Hepacivirus hominis
Confidence 9 — Direct single protein target
Curated By Expert

Target

RNA-directed RNA polymerase (CHEMBL4296320)
Type SINGLE PROTEIN
Organism Hepacivirus hominis

Publication

Simple but highly effective three-dimensional chemical-feature-based pharmacophore model for diketo acid derivatives as hepatitis C virus RNA-dependent RNA polymerase inhibitors.
Di Santo R, Fermeglia M, Ferrone M, Paneni MS, Costi R, Artico M, Roux A, Gabriele M, Tardif KD, Siddiqui A, Pricl S.
J Med Chem (2005) 48 : 6304 -6314
PubMed 16190757 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 67 5.02 7.31

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL198718 1 7.31
CHEMBL372590 1 7.25
CHEMBL362185 1 7.00
CHEMBL198423 1 7.00
CHEMBL196447 1 6.96
CHEMBL198813 1 6.85
CHEMBL196154 1 6.42
CHEMBL369909 1 6.17
CHEMBL372359 1 6.02
CHEMBL193447 1 6.00
CHEMBL426830 1 5.85
CHEMBL371987 1 5.70
CHEMBL196293 1 5.40
CHEMBL196397 1 5.34
CHEMBL16326 1 5.25
CHEMBL193671 1 5.22
CHEMBL197296 1 5.20
CHEMBL196621 1 5.17
CHEMBL196821 1 5.13
CHEMBL371538 1 5.12
CHEMBL370821 1 5.12
CHEMBL108253 1 5.10
CHEMBL197033 1 5.09
CHEMBL197557 1 5.09
CHEMBL196012 1 5.08
CHEMBL365185 1 5.00
CHEMBL370131 1 4.92
CHEMBL370124 1 4.89
CHEMBL199195 1 4.89
CHEMBL194466 1 4.89

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL198718 IC50 = 49.0 nM 7.31
CHEMBL372590 IC50 = 56.0 nM 7.25
CHEMBL198423 IC50 = 100.0 nM 7.00
CHEMBL362185 IC50 = 100.0 nM 7.00
CHEMBL196447 IC50 = 110.0 nM 6.96
CHEMBL198813 IC50 = 140.0 nM 6.85
CHEMBL196154 IC50 = 380.0 nM 6.42
CHEMBL369909 IC50 = 670.0 nM 6.17
CHEMBL372359 IC50 = 950.0 nM 6.02
CHEMBL193447 IC50 = 1000.0 nM 6.00
CHEMBL426830 IC50 = 1400.0 nM 5.85
CHEMBL371987 IC50 = 2000.0 nM 5.70
CHEMBL196293 IC50 = 4000.0 nM 5.40
CHEMBL196397 IC50 = 4600.0 nM 5.34
CHEMBL16326 IC50 = 5600.0 nM 5.25
CHEMBL193671 IC50 = 6000.0 nM 5.22
CHEMBL197296 IC50 = 6300.0 nM 5.20
CHEMBL196621 IC50 = 6700.0 nM 5.17
CHEMBL196821 IC50 = 7400.0 nM 5.13
CHEMBL371538 IC50 = 7600.0 nM 5.12
CHEMBL370821 IC50 = 7500.0 nM 5.12
CHEMBL108253 IC50 = 8000.0 nM 5.10
CHEMBL197033 IC50 = 8200.0 nM 5.09
CHEMBL197557 IC50 = 8200.0 nM 5.09
CHEMBL196012 IC50 = 8300.0 nM 5.08
CHEMBL365185 IC50 = 9900.0 nM 5.00
CHEMBL370131 IC50 = 12000.0 nM 4.92
CHEMBL370124 IC50 = 13000.0 nM 4.89
CHEMBL199195 IC50 = 13000.0 nM 4.89
CHEMBL194466 IC50 = 13000.0 nM 4.89
CHEMBL197897 IC50 = 14000.0 nM 4.85
CHEMBL198366 IC50 = 16000.0 nM 4.80
CHEMBL198879 IC50 = 16000.0 nM 4.80
CHEMBL371719 IC50 = 17000.0 nM 4.77
CHEMBL199153 IC50 = 18000.0 nM 4.75
CHEMBL262732 IC50 = 18000.0 nM 4.75
CHEMBL436119 IC50 = 18000.0 nM 4.75
CHEMBL197626 IC50 = 18000.0 nM 4.75
CHEMBL372525 IC50 = 18000.0 nM 4.75
CHEMBL194300 IC50 = 19000.0 nM 4.72
CHEMBL194519 IC50 = 19000.0 nM 4.72
CHEMBL194572 IC50 = 21000.0 nM 4.68
CHEMBL372984 IC50 = 24000.0 nM 4.62
CHEMBL197118 IC50 = 26000.0 nM 4.58
CHEMBL198878 IC50 = 27000.0 nM 4.57
CHEMBL446444 IC50 = 28000.0 nM 4.55
CHEMBL197721 IC50 = 28000.0 nM 4.55
CHEMBL371867 IC50 = 29000.0 nM 4.54
CHEMBL199200 IC50 = 30000.0 nM 4.52
CHEMBL380801 IC50 = 32000.0 nM 4.50