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Assay Detail

CHEMBL891767

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

Functional
Antagonist activity at human PXR by transient transfection assay
24
Total Activities
12
Compounds Tested
2
Activity Types
0
Assay Parameters

Assay Information

Assay Type Functional
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Intermediate

Target

Nuclear receptor subfamily 1 group I member 2 (CHEMBL3401)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Crystal structure of the PXR-T1317 complex provides a scaffold to examine the potential for receptor antagonism.
Xue Y, Chao E, Zuercher WJ, Willson TM, Collins JL, Redinbo MR.
Bioorg Med Chem (2007) 15 : 2156 -2166
PubMed 17215127 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Activity 12 - -
EC50 12 6.60 8.50

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL396952 2 8.50
CHEMBL430006 2 8.00
CHEMBL62136 T091317 2 7.90
CHEMBL242293 2 7.80
CHEMBL388024 2 6.90
CHEMBL242528 2 6.80
CHEMBL242527 2 6.30
CHEMBL242526 2 6.00
CHEMBL396953 2 6.00
CHEMBL242291 2 5.00
CHEMBL396041 2 5.00
CHEMBL389979 2 5.00

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL396952 EC50 = 3.162 nM 8.50
CHEMBL430006 EC50 = 10.0 nM 8.00
CHEMBL62136 T091317 EC50 = 12.59 nM 7.90
CHEMBL242293 EC50 = 15.85 nM 7.80
CHEMBL388024 EC50 = 125.89 nM 6.90
CHEMBL242528 EC50 = 158.49 nM 6.80
CHEMBL242527 EC50 = 501.19 nM 6.30
CHEMBL242526 EC50 = 1000.0 nM 6.00
CHEMBL396953 EC50 = 1000.0 nM 6.00
CHEMBL242291 EC50 = 10000.0 nM 5.00
CHEMBL396041 EC50 = 10000.0 nM 5.00
CHEMBL389979 EC50 = 10000.0 nM 5.00
CHEMBL242527 Activity = 104.0 % -
CHEMBL242526 Activity = 90.0 % -
CHEMBL242293 Activity = 99.0 % -
CHEMBL396952 Activity = 103.0 % -
CHEMBL388024 Activity = 101.0 % -
CHEMBL396041 Activity = 45.0 % -
CHEMBL389979 Activity = 23.0 % -
CHEMBL396953 Activity = 139.0 % -
CHEMBL62136 T091317 Activity = 93.0 % -
CHEMBL430006 Activity = 98.0 % -
CHEMBL242528 Activity = 96.0 % -
CHEMBL242291 Activity = 11.0 % -