Reaction Details Report a problem with these data
Target
Steroid hormone receptor ERR1
Ligand
BDBM50155830
Substrate
n/a
Meas. Tech.
ChEMBL_305523 (CHEMBL827660)
IC50
920±n/a nM
Citation
 Busch, BB; Stevens, WC; Martin, R; Ordentlich, P; Zhou, S; Sapp, DW; Horlick, RA; Mohan, R Identification of a selective inverse agonist for the orphan nuclear receptor estrogen-related receptor alpha. J Med Chem 47:5593-6 (2004) [PubMed]  Article 
Target
Name:
Steroid hormone receptor ERR1
Synonyms:
ERR-alpha | ERR1 | ERR1_HUMAN | ESRL1 | ESRRA | Estrogen receptor-like 1 | Estrogen-Related Receptor, alpha | Estrogen-related receptor alpha | NR3B1 | Nuclear receptor subfamily 3 group B member 1 | Steroid hormone receptor ERR1 | Steroid hormone receptor ERR1 alpha | Steroid hormone receptor ERR1/Estrogen-related receptor alpha (ERRa) | von Hippel-Lindau disease tumor suppressor/Steroid hormone receptor ERR1
Type:
PROTEIN
Mol. Mass.:
45508.08
Organism:
Homo sapiens (Human)
Description:
ChEMBL_1499891
Residue:
423
Sequence:
MSSQVVGIEPLYIKAEPASPDSPKGSSETETEPPVALAPGPAPTRCLPGHKEEEDGEGAGPGEQGGGKLVLSSLPKRLCLVCGDVASGYHYGVASCEACKAFFKRTIQGSIEYSCPASNECEITKRRRKACQACRFTKCLRVGMLKEGVRLDRVRGGRQKYKRRPEVDPLPFPGPFPAGPLAVAGGPRKTAAPVNALVSHLLVVEPEKLYAMPDPAGPDGHLPAVATLCDLFDREIVVTISWAKSIPGFSSLSLSDQMSVLQSVWMEVLVLGVAQRSLPLQDELAFAEDLVLDEEGARAAGLGELGAALLQLVRRLQALRLEREEYVLLKALALANSDSVHIEDAEAVEQLREALHEALLEYEAGRAGPGGGAERRRAGRLLLTLPLLRQTAGKVLAHFYGVKLEGKVPMHKLFLEMLEAMMD
  
Inhibitor
Name:
BDBM50155830
Synonyms:
2-Cyano-N-(5-ethyl-[1,3,4]thiadiazol-2-yl)-3-[4-(4-fluoro-2-trifluoromethyl-benzyloxy)-3-methoxy-phenyl]-acrylamide | CHEMBL361308
Type:
Small organic molecule
Emp. Form.:
C23H18F4N4O3S
Mol. Mass.:
506.473
SMILES:
CCc1nnc(NC(=O)C(=C\c2ccc(OCc3ccc(F)cc3C(F)(F)F)c(OC)c2)\C#N)s1
Structure:
Search PDB for entries with ligand similarity: