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Target
Gonadotropin-releasing hormone receptor
Ligand
BDBM50272664
Substrate
n/a
Meas. Tech.
ChEMBL_510057 (CHEMBL995200)
Ki
10.1±n/a nM
Citation
 Regan, CF; Guo, Z; Chen, Y; Huang, CQ; Chen, M; Jiang, W; Rueter, JK; Coon, T; Chen, C; Saunders, J; Brown, MS; Betz, SF; Struthers, RS; Yang, C; Wen, J; Madan, A; Zhu, YF Zwitterionic uracil derivatives as potent GnRH receptor antagonists with improved pharmaceutical properties. Bioorg Med Chem Lett 18:4503-7 (2008) [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:
BDBM50272664
Synonyms:
(R)-3-(3-(1-(2-fluoro-6-(trifluoromethyl)benzyl)-3-(2-amino-2-phenylethyl)-6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-2-fluorophenoxy)propanoic acid | CHEMBL452474
Type:
Small organic molecule
Emp. Form.:
C30H26F5N3O5
Mol. Mass.:
603.5366
SMILES:
Cc1c(-c2cccc(OCCC(O)=O)c2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F |r,wD:20.21,(1.09,-6.13,;-.24,-5.36,;-.24,-3.82,;1.09,-3.06,;2.42,-3.83,;3.75,-3.07,;3.76,-1.53,;2.42,-.75,;2.42,.79,;3.75,1.56,;3.75,3.1,;5.08,3.87,;6.42,3.1,;5.09,5.41,;1.09,-1.52,;-.25,-.75,;-1.57,-3.04,;-1.57,-1.5,;-2.9,-3.82,;-4.24,-3.05,;-5.57,-3.83,;-5.56,-5.37,;-6.9,-3.06,;-6.9,-1.52,;-8.24,-.76,;-9.57,-1.53,;-9.56,-3.08,;-8.22,-3.84,;-2.9,-5.36,;-4.23,-6.13,;-1.57,-6.12,;-1.57,-7.66,;-2.36,-8.99,;-1.52,-10.27,;.01,-10.19,;-2.22,-11.64,;-3.77,-11.72,;-4.6,-10.43,;-3.9,-9.06,;-4.73,-7.76,;-5.55,-6.46,;-6.03,-8.59,;-3.43,-6.94,)|
Structure:
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