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Assay Detail

CHEMBL951255

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

ADMET
Inhibition of human recombinant CYP2C9 expressed in Saccharomyces cerevisiae by fluorescence assay
21
Total Activities
21
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type ADMET
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Cytochrome P450 2C9 (CHEMBL3397)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Characterization of type II ligands in CYP2C9 and CYP3A4.
Ahlström MM, Zamora I.
J Med Chem (2008) 51 : 1755 -1763
PubMed 18311908 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 21 5.31 6.66

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL258502 1 6.66
CHEMBL271580 1 6.30
CHEMBL270903 1 5.89
CHEMBL406917 1 5.37
CHEMBL271121 1 5.32
CHEMBL271579 BROMUCONAZOLE 1 5.09
CHEMBL270902 1 5.00
CHEMBL271621 1 4.96
CHEMBL270272 1 4.70
CHEMBL271120 1 4.68
CHEMBL271622 1 4.41
CHEMBL407246 1 -
CHEMBL271624 1 -
CHEMBL3085388 1 -
CHEMBL410503 1 -
CHEMBL270271 ETACONAZOLE 1.0 1 -
CHEMBL271581 1 -
CHEMBL406832 1 -
CHEMBL405565 1 -
CHEMBL271620 1 -
CHEMBL271326 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL258502 IC50 = 220.0 nM 6.66
CHEMBL271580 IC50 = 500.0 nM 6.30
CHEMBL270903 IC50 = 1300.0 nM 5.89
CHEMBL406917 IC50 = 4300.0 nM 5.37
CHEMBL271121 IC50 = 4800.0 nM 5.32
CHEMBL271579 BROMUCONAZOLE IC50 = 8100.0 nM 5.09
CHEMBL270902 IC50 = 10000.0 nM 5.00
CHEMBL271621 IC50 = 11000.0 nM 4.96
CHEMBL270272 IC50 = 20000.0 nM 4.70
CHEMBL271120 IC50 = 21000.0 nM 4.68
CHEMBL271622 IC50 = 39000.0 nM 4.41
CHEMBL407246 IC50 - -
CHEMBL271624 IC50 > 50000.0 nM -
CHEMBL3085388 IC50 > 50000.0 nM -
CHEMBL410503 IC50 > 50000.0 nM -
CHEMBL270271 ETACONAZOLE IC50 > 50000.0 nM -
CHEMBL271581 IC50 > 50000.0 nM -
CHEMBL406832 IC50 > 50000.0 nM -
CHEMBL405565 IC50 > 50000.0 nM -
CHEMBL271620 IC50 > 50000.0 nM -
CHEMBL271326 IC50 > 30000.0 nM -