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Assay Detail

CHEMBL5255411

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ADMET
Non competitive inhibition of CYP2A6 in human liver microsome using coumarin as substrate preincubated with NADPH for 5 mins and measured after 30 min by fluorescence spectroscopy
1
Total Activities
1
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Cytochrome P450 2A6 (CHEMBL5282)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Synthesis and biological evaluation of coumarin derivatives as selective CYP2A6 inhibitors.
Yamaguchi Y, Nishizono N, Kobayashi D, Yoshimura T, Wada K, Kobayashi K, Oda K.
Bioorg Med Chem Lett (2023) 86 : 129206 -129206
PubMed 36889653 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 1 6.58 6.58

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL416 METHOXSALEN 4.0 1 6.58

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL416 METHOXSALEN Ki = 260.0 nM 6.58