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Assay Detail

CHEMBL4430346

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

Binding
Agonist activity at human RXR binding domain and activation domain expressed in human HCT116 cells assessed as rexinoid activity incubated for 24 hrs by luciferase reporter gene based mammalian two-hybrid assay
13
Total Activities
13
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 5 — Multiple protein complex / RNA
Curated By Autocuration

Target

Retinoid X receptor (CHEMBL2363070)
Type PROTEIN FAMILY
Organism Homo sapiens

Publication

Modeling, Synthesis, and Biological Evaluation of Potential Retinoid X Receptor (RXR)-Selective Agonists: Analogues of 4-[1-(3,5,5,8,8-Pentamethyl-5,6,7,8-tetrahydro-2-naphthyl)ethynyl]benzoic Acid (Bexarotene) and 6-(Ethyl(5,5,8,8-tetrahydronaphthalen-2-yl)amino)nicotinic Acid (NEt-TMN).
Heck MC, Wagner CE, Shahani PH, MacNeill M, Grozic A, Darwaiz T, Shimabuku M, Deans DG, Robinson NM, Salama SH, Ziller JW, Ma N, van der Vaart A, Marshall PA, Jurutka PW.
J Med Chem (2016) 59 : 8924 -8940
PubMed 27592633 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
EC50 13 7.10 8.10

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4547228 1 8.10
CHEMBL4459731 1 7.86
CHEMBL1221641 1 7.86
CHEMBL4545837 1 7.74
CHEMBL4476213 1 7.47
CHEMBL4574155 1 7.39
CHEMBL1023 BEXAROTENE 4.0 1 7.28
CHEMBL4560758 1 6.90
CHEMBL4475014 1 6.84
CHEMBL4440825 1 6.53
CHEMBL4468317 1 6.44
CHEMBL4476114 1 4.74
CHEMBL4441103 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4547228 EC50 = 7.9 nM 8.10
CHEMBL4459731 EC50 = 13.8 nM 7.86
CHEMBL1221641 EC50 = 13.8 nM 7.86
CHEMBL4545837 EC50 = 18.2 nM 7.74
CHEMBL4476213 EC50 = 33.8 nM 7.47
CHEMBL4574155 EC50 = 40.9 nM 7.39
CHEMBL1023 BEXAROTENE EC50 = 52.0 nM 7.28
CHEMBL4560758 EC50 = 125.6 nM 6.90
CHEMBL4475014 EC50 = 143.4 nM 6.84
CHEMBL4440825 EC50 = 295.5 nM 6.53
CHEMBL4468317 EC50 = 364.3 nM 6.44
CHEMBL4476114 EC50 = 18200.0 nM 4.74
CHEMBL4441103 EC50 > 80000.0 nM -