Brief Information of the Compound and Protein
Compound Name
(2S)-2-({N'-[(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-(pyridin-4-yl)propanamido]propanamido]-3-hydroxypropanamido]-3-phenylpropanoyl]hydrazinecarbonyl}amino)-N-[(1S)-1-{[(1S)-1-carbamoyl-2-(1H-indol-3-yl)ethyl]carbamoyl}-4-(1-methylcarbamimidamido)butyl]-4-methylpentanamide
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PubChem ID
CID: 118707487
Canonical SMILES
CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](Cc1ccncc1)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O
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Compound Formula C57H76N16O11
Compound Structure
Protein Name
KiSS-1 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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RF amide receptor
Uniprot ID
Q924U1
Gene Name
KISS1R
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  2
1
EC50 = 9.3 nM
   TI
   LI
   LO
   TS
2
Ki = 3.6 nM
   TI
   LI
   LO
   TS