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Target
Oxytocin receptor
Ligand
BDBM50100380
Substrate
n/a
Meas. Tech.
ChEBML_149042
IC50
5±n/a nM
Citation
 Evans, B; Pipe, A; Clark, L; Banks, M Identification of a potent and selective oxytocin antagonist, from screening a fully encoded differential release combinatorial chemical library. Bioorg Med Chem Lett 11:1297-300 (2001) [PubMed]  Article 
Target
Name:
Oxytocin receptor
Synonyms:
OT-R | OXTR | OXYR_HUMAN | Oxytocin
Type:
Enzyme Catalytic Domain
Mol. Mass.:
42793.26
Organism:
Homo sapiens (Human)
Description:
Oxytocin OXTR HEK293::B2R9L7
Residue:
389
Sequence:
MEGALAANWSAEAANASAAPPGAEGNRTAGPPRRNEALARVEVAVLCLILLLALSGNACVLLALRTTRQKHSRLFFFMKHLSIADLVVAVFQVLPQLLWDITFRFYGPDLLCRLVKYLQVVGMFASTYLLLLMSLDRCLAICQPLRSLRRRTDRLAVLATWLGCLVASAPQVHIFSLREVADGVFDCWAVFIQPWGPKAYITWITLAVYIVPVIVLAACYGLISFKIWQNLRLKTAAAAAAEAPEGAAAGDGGRVALARVSSVKLISKAKIRTVKMTFIIVLAFIVCWTPFFFVQMWSVWDANAPKEASAFIIVMLLASLNSCCNPWIYMLFTGHLFHELVQRFLCCSASYLKGRRLGETSASKKSNSSSFVLSHRSSSQRSCSQPSTA
  
Inhibitor
Name:
BDBM50100380
Synonyms:
5-Oxo-hexanoic acid (1-{[(S)-1-carbamoyl-2-(3,4-dichloro-phenyl)-ethylcarbamoyl]-methyl}-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[b]azepin-3-yl)-amide | 5-Oxo-hexanoic acid (1-{[(S)-1-carbamoyl-2-(3,4-dichloro-phenyl)-ethylcarbamoyl]-methyl}-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-amide | CHEMBL284120
Type:
Small organic molecule
Emp. Form.:
C32H31Cl2N5O5
Mol. Mass.:
636.525
SMILES:
CC(=O)CCCC(=O)NC1N=C(c2ccccc2)c2ccccc2N(CC(=O)N[C@@H](Cc2ccc(Cl)c(Cl)c2)C(N)=O)C1=O |t:10|
Structure:
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