Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(S)-2-{(2S,3R)-2-[(S)-2-({(S)-1-[(S)-2-((S)-2-Amino-5-guanidino-pentanoylamino)-5-guanidino-pentanoyl]-pyrrolidine-2-carbonyl}-amino)-3-(4-hydroxy-phenyl)-propionylamino]-3-methyl-pentanoylamino}-4-methyl-pentanoic acid
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 PubChem ID
CID: 44363934
Canonical SMILES
CC[C@@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(O)=O
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Compound Formula C38H64N12O8
Compound Structure
Protein Name
 Protein Info 
Neurotensin receptor type 1
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
>
Peptide receptor (family A GPCR)
>
Short peptide receptor (family A GPCR)
>
Neurotensin receptor
Uniprot ID
P30989
Gene Name
NTSR1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293
 Cell Line Info 
Homo sapiens (Human)  7
1
Kd = 0.46 nM
   TI
   LI
   LO
   TS
2
Kd = 0.47 nM
   TI
   LI
   LO
   TS
3
Kd = 0.63 nM
   TI
   LI
   LO
   TS
4
Kd = 0.64 nM
   TI
   LI
   LO
   TS
5
Kd = 0.74 nM
   TI
   LI
   LO
   TS
6
Kd = 0.8 nM
   TI
   LI
   LO
   TS
7
Ki = 0.63 nM
   TI
   LI
   LO
   TS
CL000007 HT-29
 Cell Line Info 
Homo sapiens (Human)  1
1
EC50 = 1 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 0.3 nM
2 IC50 = 1.4 nM
3 Kd = 0.16 nM
4 Ki = 0.14 nM
5 Ki = 0.27 nM
6 Ki = 1.05 nM