BDBM50086642 (S)-2-{(2S,3S)-2-[(S)-2-[((S)-1-{(S)-5-[2-(2-Amino-ethylamino)-ethylamino]-2-azido-pentanoyl}-pyrrolidine-2-carbonyl)-amino]-3-(4-hydroxy-phenyl)-propionylamino]-3-methyl-pentanoylamino}-4-methyl-pentanoic acid::CHEMBL139727

SMILES CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNCCNCCN)N=[N+]=[N-])C(=O)N[C@@H](CC(C)C)C(O)=O

InChI Key InChIKey=MSKWRWNESOYWSP-OBXVVNIGSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50086642   

TargetNeurotensin receptor type 1(Homo sapiens (Human))
Medical University Of South Carolina

Curated by ChEMBL
LigandPNGBDBM50086642((S)-2-{(2S,3S)-2-[(S)-2-[((S)-1-{(S)-5-[2-(2-Amino...)
Affinity DataIC50:  8.80nMAssay Description:Compound was evaluated for the binding affinity against human neurotensin receptor (hNTR)-1 expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed