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Assay Detail

CHEMBL5046967

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

ADMET
Binding affinity to recombinant CYP1A1 in human liver microsomes assessed as inhibition constant measured for 15 mins in the presence of NADPH regenerating system by EROD assay
3
Total Activities
3
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Cytochrome P450 1A1 (CHEMBL2231)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Branched alkyl of phenyl 4-(2-oxo-3-alkylimidazolidin-1-yl)benzenesulfonates as unique cytochrome P450 1A1-activated antimitotic prodrugs: Biological evaluation and mechanism of bioactivation.
Bouzriba C, Chavez Alvarez AC, Gagné-Boulet M, Ouellette V, Lacroix J, Côté MF, C-Gaudreault R, Fortin S.
Eur J Med Chem (2022) 229 : 114003 -114003
PubMed 34839998 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 3 6.20 6.52

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5077719 1 6.52
CHEMBL5073496 1 6.30
CHEMBL5084275 1 5.77

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5077719 Ki = 300.0 nM 6.52
CHEMBL5073496 Ki = 500.0 nM 6.30
CHEMBL5084275 Ki = 1700.0 nM 5.77