Brief Information of the Compound and Protein
Compound Name
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-(furan-2-ylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide
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PubChem ID
CID: 1034375
Canonical SMILES
O=C(CSc1nnc(-c2cccs2)n1Cc1ccco1)Nc1ccc2OCCOc2c1
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Compound Formula C21H18N4O4S2
Compound Structure
Protein Name
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
CL000011 CHO Cricetulus griseus (Chinese hamster)  3
1
IC50 = 2200 nM
   TI
   LI
   LO
   TS
2
Ki = 1200 nM
   TI
   LI
   LO
   TS
3
Ki = 6000 nM
   TI
   LI
   LO
   TS