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Assay Detail

CHEMBL926268

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

ADMET
Inhibition of CYP1A2
8
Total Activities
8
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 1A2 (CHEMBL3356)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Targeting cytochrome P450 enzymes: a new approach in anti-cancer drug development.
Bruno RD, Njar VC.
Bioorg Med Chem (2007) 15 : 5047 -5060
PubMed 17544277 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 8 7.36 8.22

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL283196 ALPHA-NAPHTHOFLAVONE 1 8.22
CHEMBL279564 PYRENE 1 8.15
CHEMBL122532 1 7.96
CHEMBL253346 1 7.22
CHEMBL243664 ACACETIN 1 7.10
CHEMBL40919 KAEMPFERIDE 1 5.52
CHEMBL490170 HOMOERIODICTYOL 1 -
CHEMBL342696 POLYCHLORINATED BIPHENYL 126 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL283196 ALPHA-NAPHTHOFLAVONE IC50 = 6.0 nM 8.22
CHEMBL279564 PYRENE IC50 = 7.0 nM 8.15
CHEMBL122532 IC50 = 11.0 nM 7.96
CHEMBL253346 IC50 = 60.0 nM 7.22
CHEMBL243664 ACACETIN IC50 = 80.0 nM 7.10
CHEMBL40919 KAEMPFERIDE IC50 = 3000.0 nM 5.52
CHEMBL490170 HOMOERIODICTYOL IC50 > 4000.0 nM -
CHEMBL342696 POLYCHLORINATED BIPHENYL 126 IC50 - -