Reaction Details Report a problem with these data
Target
Thyroid hormone receptor beta
Ligand
BDBM50251496
Substrate
n/a
Meas. Tech.
ChEMBL_488092 (CHEMBL986574)
EC50
70±n/a nM
Citation
 Raval, S; Raval, P; Bandyopadhyay, D; Soni, K; Yevale, D; Jogiya, D; Modi, H; Joharapurkar, A; Gandhi, N; Jain, MR; Patel, PR Design and synthesis of novel 3-hydroxy-cyclobut-3-ene-1,2-dione derivatives as thyroid hormone receptor beta (TR-beta) selective ligands. Bioorg Med Chem Lett 18:3919-24 (2008) [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:
BDBM50251496
Synonyms:
3-(3,5-dichloro-4-(4-hydroxy-3-isopropylphenoxy)phenylamino)-4-hydroxycyclobut-3-ene-1,2-dione | CHEMBL480312
Type:
Small organic molecule
Emp. Form.:
C19H15Cl2NO5
Mol. Mass.:
408.232
SMILES:
CC(C)c1cc(Oc2c(Cl)cc(Nc3c(O)c(=O)c3=O)cc2Cl)ccc1O
Structure:
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