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Target
Oxytocin receptor
Ligand
BDBM50001425
Substrate
n/a
Meas. Tech.
ChEBML_149059
IC50
10000±n/a nM
Citation
 Evans, BE; Leighton, JL; Rittle, KE; Gilbert, KF; Lundell, GF; Gould, NP; Hobbs, DW; DiPardo, RM; Veber, DF; Pettibone, DJ Orally active, nonpeptide oxytocin antagonists. J Med Chem 35:3919-27 (1992) [PubMed]  Article 
Target
Name:
Oxytocin receptor
Synonyms:
OT-R | OXYR_RAT | Otr | Oxtr | Oxytocin
Type:
Enzyme Catalytic Domain
Mol. Mass.:
42889.28
Organism:
RAT
Description:
Oxytocin OXTR RAT::P70536
Residue:
388
Sequence:
MEGTPAANWSVELDLGSGVPPGEEGNRTAGPPQRNEALARVEVAVLCLILFLALSGNACVLLALRTTRHKHSRLFFFMKHLSIADLVVAVFQVLPQLLWDITFRFYGPDLLCRLVKYLQVVGMFASTYLLLLMSLDRCLAICQPLRSLRRRTDRLAVLGTWLGCLVASAPQVHIFSLREVADGVFDCWAVFIQPWGPKAYVTWITLAVYIVPVIVLAACYGLISFKIWQNLRLKTAAAAAAAEGNDAAGGAGRAALARVSSVKLISKAKIRTVKMTFIIVLAFIVCWTPFFFVQMWSVWDVNAPKEASAFIIAMLLASLNSCCNPWIYMLFTGHLFHELVQRFFCCSARYLKGSRPGETSVSKKSNSSTFVLSRRSSSQRSCSQPSSA
  
Inhibitor
Name:
BDBM50001425
Synonyms:
1'N-(2-adamantyl)spiro[1H-indene-1,4'-(hexahydropyridine)]-1'-carboxamide | CHEMBL127119
Type:
Small organic molecule
Emp. Form.:
C24H30N2O
Mol. Mass.:
362.5078
SMILES:
O=C(NC1C2CC3CC(C2)CC1C3)N1CCC2(CC1)C=Cc1ccccc21 |c:23,TLB:2:3:10:6.12.7,5:6:3.4.9:10,THB:7:6:3:8.9.10,7:8:3:6.5.12,5:4:10:6.12.7,(-1.56,-5.36,;-.22,-4.6,;1.1,-5.39,;1.42,-6.88,;2.74,-7.45,;3.37,-8.83,;2.31,-9.95,;.71,-10.18,;.04,-8.82,;1.13,-7.65,;-1.34,-8.1,;.42,-7.99,;1.06,-9.25,;-.21,-3.06,;-1.54,-2.28,;-1.53,-.75,;-.18,,;1.13,-.75,;1.12,-2.31,;.72,1.25,;-.19,2.49,;-1.66,2.01,;-3.01,2.78,;-4.32,2.01,;-4.32,.47,;-3.01,-.3,;-1.66,.47,)|
Structure:
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