Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(S)-1-((S)-2-((S)-1-((3S,6S,9S,12S)-3-((1H-imidazol-5-yl)methyl)-1-(1-((S)-1-((S)-2-aminohexanoyl)pyrrolidine-2-carboxamido)cyclopentyl)-9-(3-guanidinopropyl)-6-(hydroxymethyl)-12-isopropyl-1,4,7,10-tetraoxo-2,5,8,11-tetraazatridecane)pyrrolidine-2-carboxamido)-3-phenylpropanoyl)pyrrolidine-2-carboxylic acid
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Canonical SMILES
CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)NC1(C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)O)C(C)C)CCCC1
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Compound Formula C56H85N15O12
Compound Structure
Protein Name
 Protein Info 
Apelin 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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Neuropeptide receptor
Uniprot ID
P35414
Gene Name
APLNR
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000025 HEK-293T
 Cell Line Info 
Homo sapiens (Human)  1
1
EC50 = 70 nM
   TI
   LI
   LO
   TS
CL000006 HEK293
 Cell Line Info 
Homo sapiens (Human)  3
1
EC50 = 1.2 nM
   TI
   LI
   LO
   TS
2
EC50 = 79 nM
   TI
   LI
   LO
   TS
3
Ki = 2.4 nM
   TI
   LI
   LO
   TS