Brief Information of the Compound and Protein
Compound Name
 Compound Info 
4-methoxy-N-[3-[(1R,3S,4R,7R,9S)-9-[3-[(4-methoxybenzoyl)amino]phenyl]-3,9-dimethyl-2,5,8-trioxa-10-azatricyclo[5.2.1.04,10]decan-3-yl]phenyl]benzamide
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 PubChem ID
CID: 168269554
Canonical SMILES
COc1ccc(cc1)C(=O)Nc1cccc(c1)[C@]1(C)O[C@@H]2CO[C@H]3N2[C@@H]1O[C@@]3(C)c1cccc(NC(=O)c2ccc(OC)cc2)c1
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Compound Formula C36H35N3O7
Compound Structure
Protein Name
 Protein Info 
Orexin/Hypocretin receptor type 1
Protein Classification
Membrane receptor
>
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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Orexin receptor
Uniprot ID
O43613
Gene Name
HCRTR1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000026 CHO-K1
 Cell Line Info 
Cricetulus griseus (Chinese hamster)  2
1
Ki = 2.17 nM
   TI
   LI
   LO
   TS
2
Ki = 5.23 nM
   TI
   LI
   LO
   TS