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Assay Detail

CHEMBL945013

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

ADMET
Inhibition of CYP2C9
18
Total Activities
17
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type ADMET
Confidence 8 — Homologous single protein target
Curated By Intermediate

Target

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

Publication

Design, synthesis, and biological evaluation of 8-biarylquinolines: a novel class of PDE4 inhibitors.
Gallant M, Chauret N, Claveau D, Day S, Deschênes D, Dubé D, Huang Z, Lacombe P, Laliberté F, Lévesque JF, Liu S, Macdonald D, Mancini J, Masson P, Mastracchio A, Nicholson D, Nicoll-Griffith DA, Perrier H, Salem M, Styhler A, Young RN, Girard Y.
Bioorg Med Chem Lett (2008) 18 : 1407 -1412
PubMed 18207397 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 18 5.59 6.96

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL403977 1 6.96
CHEMBL372575 1 6.70
CHEMBL252469 1 6.24
CHEMBL254518 1 6.20
CHEMBL402953 1 6.14
CHEMBL252490 1 5.82
CHEMBL403744 1 5.80
CHEMBL251882 1 5.80
CHEMBL253083 2 5.77
CHEMBL252089 1 5.54
CHEMBL403065 1 5.40
CHEMBL252886 1 5.14
CHEMBL252887 1 5.01
CHEMBL436847 1 4.82
CHEMBL253082 1 4.82
CHEMBL252090 1 4.58
CHEMBL251883 1 4.44

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL403977 IC50 = 110.0 nM 6.96
CHEMBL372575 IC50 = 200.0 nM 6.70
CHEMBL252469 IC50 = 580.0 nM 6.24
CHEMBL254518 IC50 = 630.0 nM 6.20
CHEMBL402953 IC50 = 730.0 nM 6.14
CHEMBL252490 IC50 = 1500.0 nM 5.82
CHEMBL403744 IC50 = 1600.0 nM 5.80
CHEMBL251882 IC50 = 1600.0 nM 5.80
CHEMBL253083 IC50 = 1700.0 nM 5.77
CHEMBL252089 IC50 = 2900.0 nM 5.54
CHEMBL253083 IC50 = 3200.0 nM 5.50
CHEMBL403065 IC50 = 4000.0 nM 5.40
CHEMBL252886 IC50 = 7200.0 nM 5.14
CHEMBL252887 IC50 = 9800.0 nM 5.01
CHEMBL436847 IC50 = 15000.0 nM 4.82
CHEMBL253082 IC50 = 15000.0 nM 4.82
CHEMBL252090 IC50 = 26000.0 nM 4.58
CHEMBL251883 IC50 = 36000.0 nM 4.44