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Assay Detail

CHEMBL4035337

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

Binding
Competitive inhibition of CYP1B1 (unknown origin) expressed in yeast microsomes using (-)benzo[a]pyrene-7R-trans-7,8-dihyrodiol (B[a]P-7,8-diol) as substrate
4
Total Activities
4
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

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

Publication

Inhibitors of cytochrome P450 (CYP) 1B1.
Dutour R, Poirier D.
Eur J Med Chem (2017) 135 : 296 -306
PubMed 28458135 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 4 5.39 6.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL453805 PENTOSALEN -1.0 1 6.00
CHEMBL448060 ISOIMPERATORIN 1 5.22
CHEMBL140796 ISOPIMPINELLIN 1 4.96
CHEMBL1078442 BERGAMOTTIN 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL453805 PENTOSALEN Ki = 1000.0 nM 6.00
CHEMBL448060 ISOIMPERATORIN Ki = 6000.0 nM 5.22
CHEMBL140796 ISOPIMPINELLIN Ki = 11000.0 nM 4.96
CHEMBL1078442 BERGAMOTTIN Ki = 587000.0 nM -