Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(1R,6R,9R,15S,18R,21S,24R,29R,32S,35R)-29-acetamido-32-[(4-chlorophenyl)methyl]-15,21-bis[3-(diaminomethylideneamino)propyl]-35-(1H-indol-3-ylmethyl)-18-(2-methylpropyl)-3,8,14,17,20,23,30,33,36,38-decaoxo-26,27-dithia-4,7,13,16,19,22,31,34,37,39-decazatricyclo[22.13.2.09,13]nonatriacontane-6-carboxamide
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 PubChem ID
CID: 44379836
Canonical SMILES
CC(C)C[C@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]2CSSC[C@H](NC(C)=O)C(=O)N[C@@H](Cc3ccc(Cl)cc3)C(=O)N[C@H](Cc3c[nH]c4ccccc34)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 C58H82ClN19O12S2
Compound Structure
Protein Name
 Protein Info 
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
 Cell Line Info 
Homo sapiens (Human)  1
1
Ki = 89 nM
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   LI
   LO
   TS