BDBM50038411 1-[2-Amino-3-(4-hydroxy-phenyl)-propionyl]-6-benzyl-9-mercaptomethyl-3-(1-mercapto-1-methyl-ethyl)-[1,4,7]triazonane-2,5,8-trione::CHEMBL2369137

SMILES CC(C)(S)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CS)N(C(=O)[C@@H](N)Cc2ccc(O)cc2)C1=O

InChI Key InChIKey=SZAZZVFPYPEPBV-UHFFFAOYSA-N

Data  2 KI  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50038411   

TargetMu-type opioid receptor(Guinea pig)
University of Michigan

Curated by ChEMBL
LigandPNGBDBM50038411(1-[2-Amino-3-(4-hydroxy-phenyl)-propionyl]-6-benzy...)
Affinity DataIC50: 463nMAssay Description:Agonist activity was assessed in an guinea pig ileum (GPI) smooth muscle bioassayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetDelta-type opioid receptor(Mouse)
University of Michigan

Curated by ChEMBL
LigandPNGBDBM50038411(1-[2-Amino-3-(4-hydroxy-phenyl)-propionyl]-6-benzy...)
Affinity DataIC50: 4.20nMAssay Description:Agonist activity was assessed in mouse vas deferens (MVD) smooth muscle bioassayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetDelta-type opioid receptor(Mouse)
University of Michigan

Curated by ChEMBL
LigandPNGBDBM50038411(1-[2-Amino-3-(4-hydroxy-phenyl)-propionyl]-6-benzy...)
Affinity DataKi:  0.740nMAssay Description:Binding affinity for delta opioid receptor using [3H]DPDPE from mouse vas deferensMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetMu-type opioid receptor(Guinea pig)
University of Michigan

Curated by ChEMBL
LigandPNGBDBM50038411(1-[2-Amino-3-(4-hydroxy-phenyl)-propionyl]-6-benzy...)
Affinity DataKi:  52nMAssay Description:Binding affinity against mu opioid receptor using [3H]DAMGO in guinea pig ileumMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed