Reaction Details Report a problem with these data
Target
Thyroid hormone receptor beta
Ligand
BDBM50389763
Substrate
n/a
Meas. Tech.
ChEMBL_834215 (CHEMBL2072982)
IC50
1400±n/a nM
Citation
 Hwang, JY; Attia, RR; Zhu, F; Yang, L; Lemoff, A; Jeffries, C; Connelly, MC; Guy, RK Synthesis and evaluation of sulfonylnitrophenylthiazoles (SNPTs) as thyroid hormone receptor-coactivator interaction inhibitors. J Med Chem 55:2301-10 (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:
BDBM50389763
Synonyms:
CHEMBL2070232
Type:
Small organic molecule
Emp. Form.:
C22H21N3O5S2
Mol. Mass.:
471.549
SMILES:
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)-c1nc(c(s1)C(=O)N1CCCCC1)-c1ccccc1
Structure:
Search PDB for entries with ligand similarity: