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Assay Detail

CHEMBL3531531

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

ADMET
Activation of human PXR expressed in human HepG2 (DPX-2) cells after 24 hrs by luciferase reporter gene based luminescent analysis
52
Total Activities
52
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type ADMET
Organism Homo sapiens
Cell Type HepG2
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

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

Publication

Identification of clinically used drugs that activate pregnane X receptors.
Shukla SJ, Sakamuru S, Huang R, Moeller TA, Shinn P, Vanleer D, Auld DS, Austin CP, Xia M.
Drug Metab Dispos (2011) 39 : 151 -159
PubMed 20966043 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
EC50 52 4.90 5.70

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL517427 NILVADIPINE 3.0 1 5.70
CHEMBL2356116 1 5.50
CHEMBL374478 RIFAMPIN 4.0 1 5.46
CHEMBL40883 1 5.46
CHEMBL1480 FELODIPINE 4.0 1 5.41
CHEMBL1535402 1 5.40
CHEMBL1200617 RIMEXOLONE 4.0 1 5.40
CHEMBL1891684 RIODIPINE 2.0 1 5.40
CHEMBL163 RITONAVIR 4.0 1 5.40
CHEMBL1201065 THIAMYLAL SODIUM 4.0 1 5.39
CHEMBL1475693 FAMPROFAZONE 2.0 1 5.29
CHEMBL13828 OXATOMIDE 2.0 1 5.15
CHEMBL52606 COLFORSIN 2.0 1 5.10
CHEMBL1714574 TERCONAZOLE 4.0 1 5.05
CHEMBL998 LORATADINE 4.0 1 5.00
CHEMBL37161 FENBENDAZOLE 2.0 1 5.00
CHEMBL1726 NISOLDIPINE 4.0 1 5.00
CHEMBL1870919 BUMECAINE 2.0 1 4.96
CHEMBL1702784 1 4.95
CHEMBL1200902 1 4.90
CHEMBL242080 E319 1 4.90
CHEMBL1411951 1 4.90
CHEMBL312862 DEMECOLCINE 2.0 1 4.90
CHEMBL94657 PATUPILONE 3.0 1 4.90
CHEMBL1200600 FLUOROMETHOLONE 4.0 1 4.90
CHEMBL7002 CIGLITAZONE 2.0 1 4.85
CHEMBL1735 INDINAVIR SULFATE 4.0 1 4.85
CHEMBL1617 RIFAXIMIN 4.0 1 4.85
CHEMBL1318553 1 4.85
CHEMBL957 BOSENTAN 4.0 1 4.85

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL517427 NILVADIPINE EC50 = 2000.0 nM 5.70
CHEMBL2356116 EC50 = 3200.0 nM 5.50
CHEMBL374478 RIFAMPIN EC50 = 3500.0 nM 5.46
CHEMBL40883 EC50 = 3500.0 nM 5.46
CHEMBL1480 FELODIPINE EC50 = 3900.0 nM 5.41
CHEMBL1535402 EC50 = 4000.0 nM 5.40
CHEMBL1200617 RIMEXOLONE EC50 = 4000.0 nM 5.40
CHEMBL1891684 RIODIPINE EC50 = 4000.0 nM 5.40
CHEMBL163 RITONAVIR EC50 = 4000.0 nM 5.40
CHEMBL1201065 THIAMYLAL SODIUM EC50 = 4100.0 nM 5.39
CHEMBL1475693 FAMPROFAZONE EC50 = 5100.0 nM 5.29
CHEMBL13828 OXATOMIDE EC50 = 7100.0 nM 5.15
CHEMBL52606 COLFORSIN EC50 = 7900.0 nM 5.10
CHEMBL1714574 TERCONAZOLE EC50 = 8900.0 nM 5.05
CHEMBL1726 NISOLDIPINE EC50 = 10000.0 nM 5.00
CHEMBL37161 FENBENDAZOLE EC50 = 10000.0 nM 5.00
CHEMBL998 LORATADINE EC50 = 10000.0 nM 5.00
CHEMBL1870919 BUMECAINE EC50 = 11000.0 nM 4.96
CHEMBL1702784 EC50 = 11200.0 nM 4.95
CHEMBL1200902 EC50 = 12600.0 nM 4.90
CHEMBL242080 E319 EC50 = 12600.0 nM 4.90
CHEMBL1411951 EC50 = 12600.0 nM 4.90
CHEMBL312862 DEMECOLCINE EC50 = 12600.0 nM 4.90
CHEMBL94657 PATUPILONE EC50 = 12600.0 nM 4.90
CHEMBL1200600 FLUOROMETHOLONE EC50 = 12600.0 nM 4.90
CHEMBL7002 CIGLITAZONE EC50 = 14100.0 nM 4.85
CHEMBL603 ZAFIRLUKAST EC50 = 14100.0 nM 4.85
CHEMBL957 BOSENTAN EC50 = 14100.0 nM 4.85
CHEMBL1617 RIFAXIMIN EC50 = 14100.0 nM 4.85
CHEMBL1735 INDINAVIR SULFATE EC50 = 14100.0 nM 4.85
CHEMBL1318553 EC50 = 14100.0 nM 4.85
CHEMBL1080983 FEBANTEL EC50 = 15800.0 nM 4.80
CHEMBL300555 SPIROXATRINE EC50 = 20000.0 nM 4.70
CHEMBL2361572 EC50 = 22400.0 nM 4.65
CHEMBL450613 ZERANOL EC50 = 23700.0 nM 4.62
CHEMBL1200807 NORELGESTROMIN EC50 = 25100.0 nM 4.60
CHEMBL2107554 SODIUM DIBUNATE EC50 = 25100.0 nM 4.60
CHEMBL347036 PROADIFEN HYDROCHLORIDE EC50 = 25100.0 nM 4.60
CHEMBL1351761 DINALINE EC50 = 28200.0 nM 4.55
CHEMBL304818 DOCEBENONE EC50 = 28200.0 nM 4.55
CHEMBL1200402 AMLODIPINE BESYLATE EC50 = 31600.0 nM 4.50
CHEMBL2104261 ENZACAMENE EC50 = 31600.0 nM 4.50
CHEMBL1111 AMBRISENTAN EC50 = 31600.0 nM 4.50
CHEMBL3189011 EC50 = 31600.0 nM 4.50
CHEMBL465 DRONABINOL EC50 = 31600.0 nM 4.50
CHEMBL408 TROGLITAZONE EC50 = 31600.0 nM 4.50
CHEMBL284733 DICLAZURIL EC50 = 31600.0 nM 4.50
CHEMBL596 FENTANYL EC50 = 31600.0 nM 4.50
CHEMBL98 VORINOSTAT EC50 = 35500.0 nM 4.45
CHEMBL1200596 CHLOROXINE EC50 = 39800.0 nM 4.40