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Assay Detail

CHEMBL4201920

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

Binding
Inhibition of recombinant human CYP1B1 incubated for 45 mins using 7-ethyl-O-resorufin substrate in presence of NADPH regenerating system by fluorescence based ethoxyresorufin-O-deethylase assay
5
Total Activities
5
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Cytochrome P450 1B1 (CHEMBL4878)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Targeting Cytochrome P450 (CYP) 1B1 Enzyme with Four Series of A-Ring Substituted Estrane Derivatives: Design, Synthesis, Inhibitory Activity, and Selectivity.
Dutour R, Roy J, Cortés-Benítez F, Maltais R, Poirier D.
J Med Chem (2018) 61 : 9229 -9245
PubMed 30216063 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 5 6.51 6.62

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL283196 ALPHA-NAPHTHOFLAVONE 1 6.62
CHEMBL4172273 1 6.62
CHEMBL4215891 1 6.62
CHEMBL4218514 1 6.43
CHEMBL4205335 1 6.27

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL283196 ALPHA-NAPHTHOFLAVONE IC50 = 240.0 nM 6.62
CHEMBL4172273 IC50 = 240.0 nM 6.62
CHEMBL4215891 IC50 = 240.0 nM 6.62
CHEMBL4218514 IC50 = 370.0 nM 6.43
CHEMBL4205335 IC50 = 540.0 nM 6.27