Brief Information of the Compound and Protein
Compound Name
 Compound Info 
2,2',2''-(10-(2-((R)-1-((S)-2-((2S,5S,8S,11S,17S)-11-((1H-indol-3-yl)methyl)-1-amino-8-butyl-5-(carboxymethyl)-18-(4-hydroxyphenyl)-9-methyl-2-(naphthalen-1-ylmethyl)-1,4,7,10,13,16-hexaoxo-3,6,9,12,15-pentaazaoctadecan-17-ylcarbamoyl)pyrrolidin-1-yl)-4-carboxy-1-oxobutan-2-ylamino)-2-oxoethyl)-1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetic acid
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Canonical SMILES
CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1cccc2ccccc12)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCC(=O)O)NC(=O)CN1CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC1
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Compound Formula C72H94N14O20
Compound Structure
Protein Name
 Protein Info 
Gastrin/cholecystokinin type B receptor
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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Cholecystokinin receptor
Uniprot ID
P30553
Gene Name
CCKBR
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000383 AR42J
 Cell Line Info 
Rattus norvegicus (Rat)  1
1
EC50 = 1.74 nM
   TI
   LI
   LO
   TS