Target
Nuclear receptor subfamily 2 group E member 1
Ligand
BDBM50584389
Substrate
n/a
Meas. Tech.
ChEMBL_2159732 (CHEMBL5044482)
EC50
700±n/a nM
Citation
 Faudone, GZhubi, RCelik, FKnapp, SChaikuad, AHeering, JMerk, D Design of a Potent TLX Agonist by Rational Fragment Fusion. J Med Chem 65:2288-2296 (2022) [PubMed]  Article 
Target
Name:
Nuclear receptor subfamily 2 group E member 1
Synonyms:
NR2E1 | NR2E1_HUMAN | Nuclear receptor TLX | Protein tailless homolog | TLX | Tll | hTll
Type:
PROTEIN
Mol. Mass.:
42606.25
Organism:
Homo sapiens
Description:
ChEMBL_104473
Residue:
385
Sequence:
MSKPAGSTSRILDIPCKVCGDRSSGKHYGVYACDGCSGFFKRSIRRNRTYVCKSGNQGGCPVDKTHRNQCRACRLKKCLEVNMNKDAVQHERGPRTSTIRKQVALYFRGHKEENGAAAHFPSAALPAPAFFTAVTQLEPHGLELAAVSTTPERQTLVSLAQPTPKYPHEVNGTPMYLYEVATESVCESAARLLFMSIKWAKSVPAFSTLSLQDQLMLLEDAWRELFVLGIAQWAIPVDANTLLAVSGMNGDNTDSQKLNKIISEIQALQEVVARFRQLRLDATEFACLKCIVTFKAVPTHSGSELRSFRNAAAIAALQDEAQLTLNSYIHTRYPTQPCRFGKLLLLLPALRSISPSTIEEVFFKKTIGNVPITRLLSDMYKSSDI
  
Inhibitor
Name:
BDBM50584389
Synonyms:
CHEMBL5080383
Type:
Small organic molecule
Emp. Form.:
C25H23F3N4O2
Mol. Mass.:
468.4709
SMILES:
CCCCOc1cc(C(=O)Nc2cc(cc(c2)C(F)(F)F)-n2cnc(C)c2)c2ccccc2n1
Structure:
Search PDB for entries with ligand similarity: