Brief Information of the Compound and Protein
Compound Name
 Compound Info 
1-[3-[(1R,4S,10S,13R,16S,19S,25S,28S,31R,34S,37R,40S,43S,46S)-37-benzyl-28-[(2S)-butan-2-yl]-16-(3-carbamimidamidopropyl)-34-(1H-imidazol-4-ylmethyl)-4,19,43-tris(1H-indol-3-ylmethyl)-15,46-dimethyl-13-(naphthalen-2-ylmethyl)-2,5,11,14,17,20,26,29,32,35,38,41,44,47-tetradecaoxo-50,51-dithia-3,6,12,15,18,21,27,30,33,36,39,42,45,48-tetradecazatetracyclo[29.17.4.06,10.021,25]dopentacontan-40-yl]propyl]guanidine
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 PubChem ID
CID: 166626130
Canonical SMILES
CC[C@H](C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(=N)N)N(C)C(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c3ccccc13)C(=O)N[C@@H](C)C(=O)N2
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Compound Formula C99H121N25O14S2
Compound Structure
Protein Name
 Protein Info 
Melanocortin receptor 4
Protein Classification
Membrane receptor
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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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Melanocortin receptor
Uniprot ID
P32245
Gene Name
MC4R
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000058 T-REx-293
 Cell Line Info 
Homo sapiens (Human)  1
1
EC50 = 31.62 nM
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