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Assay Detail

CHEMBL3266219

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

Binding
Agonist activity at recombinant His6-tagged THR-alpha (unknown origin) expressed in Escherichia coli BL21(DE3) co-expressing RXR preincubated for 30 mins assessed as biotin-GRIP1 peptide recruitment by HTRF assay
22
Total Activities
22
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

Thyroid hormone receptor alpha (CHEMBL1860)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery of 2-[3,5-dichloro-4-(5-isopropyl-6-oxo-1,6-dihydropyridazin-3-yloxy)phenyl]-3,5-dioxo-2,3,4,5-tetrahydro[1,2,4]triazine-6-carbonitrile (MGL-3196), a Highly Selective Thyroid Hormone Receptor β agonist in clinical trials for the treatment of dyslipidemia.
Kelly MJ, Pietranico-Cole S, Larigan JD, Haynes NE, Reynolds CH, Scott N, Vermeulen J, Dvorozniak M, Conde-Knape K, Huang KS, So SS, Thakkar K, Qian Y, Banner B, Mennona F, Danzi S, Klein I, Taub R, Tilley J.
J Med Chem (2014) 57 : 3912 -3923
PubMed 24712661 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
EC50 22 6.08 8.52

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL107400 SOBETIROME 2.0 1 8.52
CHEMBL41036 1 8.30
CHEMBL1544 LIOTHYRONINE 4.0 1 8.00
CHEMBL3261325 1 6.68
CHEMBL3261333 1 6.48
CHEMBL3261322 1 6.41
CHEMBL3261335 1 6.39
CHEMBL3261324 1 6.16
CHEMBL3261327 1 6.12
CHEMBL3261323 1 6.11
CHEMBL3261336 1 6.09
CHEMBL3261334 1 5.90
CHEMBL3261332 1 5.56
CHEMBL3261321 1 5.48
CHEMBL3261331 RESMETIROM 4.0 1 5.43
CHEMBL3261326 1 5.37
CHEMBL3261320 1 5.15
CHEMBL3261328 1 5.05
CHEMBL3261319 1 4.92
CHEMBL3261330 1 4.84
CHEMBL3261318 1 4.81
CHEMBL3261329 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL107400 SOBETIROME EC50 = 3.0 nM 8.52
CHEMBL41036 EC50 = 5.0 nM 8.30
CHEMBL1544 LIOTHYRONINE EC50 = 10.0 nM 8.00
CHEMBL3261325 EC50 = 210.0 nM 6.68
CHEMBL3261333 EC50 = 330.0 nM 6.48
CHEMBL3261322 EC50 = 390.0 nM 6.41
CHEMBL3261335 EC50 = 410.0 nM 6.39
CHEMBL3261324 EC50 = 700.0 nM 6.16
CHEMBL3261327 EC50 = 750.0 nM 6.12
CHEMBL3261323 EC50 = 780.0 nM 6.11
CHEMBL3261336 EC50 = 820.0 nM 6.09
CHEMBL3261334 EC50 = 1250.0 nM 5.90
CHEMBL3261332 EC50 = 2750.0 nM 5.56
CHEMBL3261321 EC50 = 3280.0 nM 5.48
CHEMBL3261331 RESMETIROM EC50 = 3740.0 nM 5.43
CHEMBL3261326 EC50 = 4290.0 nM 5.37
CHEMBL3261320 EC50 = 7010.0 nM 5.15
CHEMBL3261328 EC50 = 8880.0 nM 5.05
CHEMBL3261319 EC50 = 12000.0 nM 4.92
CHEMBL3261330 EC50 = 14390.0 nM 4.84
CHEMBL3261318 EC50 = 15640.0 nM 4.81
CHEMBL3261329 EC50 - -