Reaction Details Report a problem with these data
Target
Thyroid hormone receptor beta
Ligand
BDBM50385103
Substrate
n/a
Meas. Tech.
ChEMBL_821529 (CHEMBL2038197)
Ki
213±n/a nM
Citation
 Shiohara, H; Nakamura, T; Kikuchi, N; Ozawa, T; Nagano, R; Matsuzawa, A; Ohnota, H; Miyamoto, T; Ichikawa, K; Hashizume, K Discovery of novel indane derivatives as liver-selective thyroid hormone receptorß (TRß) agonists for the treatment of dyslipidemia. Bioorg Med Chem 20:3622-34 (2012) [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:
BDBM50385103
Synonyms:
CHEMBL2035883
Type:
Small organic molecule
Emp. Form.:
C21H25NO6S
Mol. Mass.:
419.491
SMILES:
CC(C)c1cc(Oc2c3CCCc3c(NS(=O)(=O)CC(O)=O)cc2C)ccc1O
Structure:
Search PDB for entries with ligand similarity: