Brief Information of the Compound and Protein
Compound Name
(1R,6R,9R,15S,18R,21R,24R,33R,36S,39R)-33-acetamido-15-(3-carbamimidamidopropyl)-36-[(4-chlorophenyl)methyl]-18-(2-methylpropyl)-21,39-bis(naphthalen-2-ylmethyl)-3,8,14,17,20,23,28,31,34,37,40,42-dodecaoxo-4,7,13,16,19,22,27,30,35,38,41,43-dodecazatricyclo[22.17.2.09,13]tritetracontane-6-carboxamide
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PubChem ID
CID: 44379865
Canonical SMILES
CC(C)C[C@H]1NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H]2CCNC(=O)CNC(=O)C[C@@H](NC(C)=O)C(=O)N[C@@H](Cc3ccc(Cl)cc3)C(=O)N[C@H](Cc3ccc4ccccc4c3)C(=O)N[C@H](CC(=O)NC[C@@H](NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)C(=O)N2
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Compound Formula C71H88ClN17O14
Compound Structure
Protein Name
Gonadotropin-releasing hormone receptor
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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GnRH receptor
Uniprot ID
P30969
Gene Name
GNRHR
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
Ki = 0.38 nM
   TI
   LI
   LO
   TS