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Target
Gonadotropin-releasing hormone receptor
Ligand
BDBM50168715
Substrate
n/a
Meas. Tech.
ChEMBL_303748 (CHEMBL829791)
Ki
24±n/a nM
Citation
 Guo, Z; Wu, D; Zhu, YF; Tucci, FC; Regan, CF; Rowbottom, MW; Struthers, RS; Xie, Q; Reijmers, S; Sullivan, SK; Sai, Y; Chen, C Structure-activity relationships of 1,3,5-triazine-2,4,6-triones as human gonadotropin-releasing hormone receptor antagonists. Bioorg Med Chem Lett 15:3685-90 (2005) [PubMed]  Article 
Target
Name:
Gonadotropin-releasing hormone receptor
Synonyms:
GNRHR | GNRHR_HUMAN | GRHR | GnRH receptor | GnRH-R | Gonadotropin releasing hormone 1 (GnRHR1) | Gonadotropin-releasing hormone receptor | Gonadotropin-releasing hormone receptor (GnRH)
Type:
Enzyme
Mol. Mass.:
37749.45
Organism:
Homo sapiens (Human)
Description:
P30968
Residue:
328
Sequence:
MANSASPEQNQNHCSAINNSIPLMQGNLPTLTLSGKIRVTVTFFLFLLSATFNASFLLKLQKWTQKKEKGKKLSRMKLLLKHLTLANLLETLIVMPLDGMWNITVQWYAGELLCKVLSYLKLFSMYAPAFMMVVISLDRSLAITRPLALKSNSKVGQSMVGLAWILSSVFAGPQLYIFRMIHLADSSGQTKVFSQCVTHCSFSQWWHQAFYNFFTFSCLFIIPLFIMLICNAKIIFTLTRVLHQDPHELQLNQSKNNIPRARLKTLKMTVAFATSFTVCWTPYYVLGIWYWFDPEMLNRLSDPVNHFFFLFAFLNPCFDPLIYGYFSL
  
Inhibitor
Name:
BDBM50168715
Synonyms:
1-((S)-3-Amino-3-phenyl-propyl)-3-(2,6-difluoro-benzyl)-5-(2-fluoro-3-methoxy-phenyl)-[1,3,5]triazinane-2,4,6-trione | CHEMBL360047
Type:
Small organic molecule
Emp. Form.:
C26H23F3N4O4
Mol. Mass.:
512.4804
SMILES:
COc1cccc(c1F)-n1c(=O)n(CC[C@H](N)c2ccccc2)c(=O)n(Cc2c(F)cccc2F)c1=O |wD:15.16,(10.27,2.14,;8.94,1.37,;8.94,-.17,;10.29,-.94,;10.29,-2.48,;8.94,-3.25,;7.61,-2.48,;7.61,-.94,;6.28,-.17,;6.28,-3.25,;4.95,-2.48,;4.95,-.94,;3.62,-3.25,;2.27,-4.02,;.94,-3.23,;-.39,-4,;-.41,-5.54,;-1.72,-3.2,;-3.05,-3.97,;-4.38,-3.2,;-4.36,-1.66,;-3.03,-.89,;-1.7,-1.66,;3.62,-4.79,;2.29,-5.56,;4.95,-5.56,;4.95,-7.1,;6.28,-7.87,;6.28,-9.41,;4.93,-10.18,;7.61,-10.18,;8.94,-9.41,;8.94,-7.87,;7.61,-7.1,;6.26,-6.33,;6.28,-4.79,;7.61,-5.56,)|
Structure:
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