Reaction Details Report a problem with these data
Target
Thyroid hormone receptor beta
Ligand
BDBM50446348
Substrate
n/a
Meas. Tech.
ChEMBL_1286987 (CHEMBL3111152)
IC50
24100±n/a nM
Citation
 Sidhu, PS; Nassif, N; McCallum, MM; Teske, K; Feleke, B; Yuan, NY; Nandhikonda, P; Cook, JM; Singh, RK; Bikle, DD; Arnold, LA Development of novel Vitamin D Receptor-Coactivator Inhibitors. ACS Med Chem Lett 5:199-204 (2014) [PubMed]  Article 
Target
Name:
Thyroid hormone receptor beta
Synonyms:
ERBA2 | NR1A2 | Nuclear receptor subfamily 1 group A member 2 | THB_HUMAN | THR1 | THRB | c-erbA-2 | c-erbA-beta
Type:
Receptor
Mol. Mass.:
52793.62
Organism:
Homo sapiens (Human)
Description:
Recombinant hThR was obtained from nuclear extracts from SF9 cells infected with baculovirus vectors encoding for ThRbeta 1.
Residue:
461
Sequence:
MTPNSMTENGLTAWDKPKHCPDREHDWKLVGMSEACLHRKSHSERRSTLKNEQSSPHLIQTTWTSSIFHLDHDDVNDQSVSSAQTFQTEEKKCKGYIPSYLDKDELCVVCGDKATGYHYRCITCEGCKGFFRRTIQKNLHPSYSCKYEGKCVIDKVTRNQCQECRFKKCIYVGMATDLVLDDSKRLAKRKLIEENREKRRREELQKSIGHKPEPTDEEWELIKTVTEAHVATNAQGSHWKQKRKFLPEDIGQAPIVNAPEGGKVDLEAFSHFTKIITPAITRVVDFAKKLPMFCELPCEDQIILLKGCCMEIMSLRAAVRYDPESETLTLNGEMAVTRGQLKNGGLGVVSDAIFDLGMSLSSFNLDDTEVALLQAVLLMSSDRPGLACVERIEKYQDSFLLAFEHYINYRKHHVTHFWPKLLMKVTDLRMIGACHASRFLHMKVECPTELFPPLFLEVFED
  
Inhibitor
Name:
BDBM50446348
Synonyms:
CHEMBL3109600
Type:
Small organic molecule
Emp. Form.:
C24H20ClF3N2O
Mol. Mass.:
444.877
SMILES:
Cc1[nH]c2cc(C)ccc2c1C(Nc1ccc(OC(F)(F)F)cc1)c1ccccc1Cl
Structure:
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