Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(S)-1-((4R,7S,10S,13S,16S,19R)-4-amino-16-(2-amino-2-oxoethyl)-13-(3-amino-3-oxopropyl)-10-sec-butyl-7-(4-hydroxybenzyl)-5,8,11,14,17-pentaoxo-1-thia-2-selena-6,9,12,15,18-pentaazacycloicosane-19-carbonyl)-N-((S)-1-(2-amino-2-oxoethylamino)-3-methylbutyl)pyrrolidine-2-carboxamide
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 PubChem ID
CID: 53316559
Canonical SMILES
CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](N)C[Se]SC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)NCC(N)=O
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Compound Formula C42H66N12O11SSe
Compound Structure
Protein Name
 Protein Info 
Oxytocin receptor
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
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Peptide receptor (family A GPCR)
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Short peptide receptor (family A GPCR)
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Vasopressin and oxytocin receptor
Uniprot ID
P30559
Gene Name
OXTR
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000109 COS-1
 Cell Line Info 
Chlorocebus aethiops (Green monkey)  2
1
EC50 = 2.6 nM
   TI
   LI
   LO
   TS
2
Ki = 0.29 nM
   TI
   LI
   LO
   TS