Brief Information of the Compound and Protein
Compound Name
(2S)-1-[(3S,6S,9S,12S,15S,18S,21R)-21-[[(2R)-2-acetamido-3-naphthalen-2-ylpropanoyl]amino]-12-[3-(diaminomethylideneamino)propyl]-15-methyl-6-(2-methylpropyl)-9-(naphthalen-2-ylmethyl)-5,8,11,14,17,20,23-heptaoxo-18-(pyridin-3-ylmethyl)-1,4,7,10,13,16,19-heptazacyclotricosane-3-carbonyl]-N-[(2S)-1-amino-1-oxopropan-2-yl]pyrrolidine-2-carboxamide
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PubChem ID
CID: 44379748
Canonical SMILES
CC(C)C[C@@H]1NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](C)NC(=O)[C@H](Cc2cccnc2)NC(=O)[C@@H](CC(=O)NC[C@H](NC1=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O
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Compound Formula C66H84N16O12
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 = 67 nM
   TI
   LI
   LO
   TS