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Assay Detail

CHEMBL4683857

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Binding
Inhibition of recombinant human CYP1B1 expressed in baculovirus infected insect cells using 7-ethoxyresorufin as substrate preincubated for 5 mins followed by NADPH addition and measured after 15 mins by EROD assay
13
Total Activities
13
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

Design and synthesis of α-naphthoflavone chimera derivatives able to eliminate cytochrome P450 (CYP)1B1-mediated drug resistance via targeted CYP1B1 degradation.
Zhou L,Chen W,Cao C,Shi Y,Ye W,Hu J,Wang L,Zhou W
Eur J Med Chem (2020) 189 : 112028 -112028
PubMed 31945665 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 13 8.02 9.40

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4748722 1 9.40
CHEMBL3422338 1 9.22
CHEMBL3422257 1 8.85
CHEMBL4792004 1 8.68
CHEMBL283196 ALPHA-NAPHTHOFLAVONE 1 8.39
CHEMBL4757820 1 7.02
CHEMBL4749570 1 7.00
CHEMBL4763775 1 6.82
CHEMBL4746654 1 6.78
CHEMBL4751054 1 -
CHEMBL4787701 1 -
CHEMBL4786434 1 -
CHEMBL4745698 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4748722 IC50 = 0.4 nM 9.40
CHEMBL3422338 IC50 = 0.6 nM 9.22
CHEMBL3422257 IC50 = 1.4 nM 8.85
CHEMBL4792004 IC50 = 2.1 nM 8.68
CHEMBL283196 ALPHA-NAPHTHOFLAVONE IC50 = 4.1 nM 8.39
CHEMBL4757820 IC50 = 95.1 nM 7.02
CHEMBL4749570 IC50 = 101.2 nM 7.00
CHEMBL4763775 IC50 = 152.7 nM 6.82
CHEMBL4746654 IC50 = 166.2 nM 6.78
CHEMBL4751054 IC50 > 10000.0 nM -
CHEMBL4787701 IC50 > 10000.0 nM -
CHEMBL4786434 IC50 > 10000.0 nM -
CHEMBL4745698 IC50 > 10000.0 nM -