Brief Information of the Compound and Protein
Compound Name
(1R,4S,7S,13S,16S,21S,24R,27R,34S)-27-[[(2R)-2-acetamido-3-naphthalen-2-ylpropanoyl]amino]-7-[3-(diaminomethylideneamino)propyl]-34-[(4-hydroxyphenyl)methyl]-24-(1H-indol-3-ylmethyl)-4-(2-methylpropyl)-2,5,8,14,19,23,26,33,36-nonaoxo-29,30-dithia-3,6,9,15,18,22,25,32,35-nonazatricyclo[19.10.5.09,13]hexatriacontane-16-carboxamide
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PubChem ID
CID: 44380255
Canonical SMILES
CC(C)C[C@@H]1NC(=O)[C@@H]2CSSC[C@H](NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC(C)=O)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)N[C@@H](Cc1ccc(O)cc1)C(=O)N2
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Compound Formula C65H82N16O13S2
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 = 13 nM
   TI
   LI
   LO
   TS