BDBM50059367 (S)-2-[2-((S)-2-{(R)-2-[(S)-2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-propionylamino}-3-phenyl-propionylamino)-2-methyl-propionylamino]-N-[(S)-1-(carbamoylmethyl-carbamoyl)-2-methyl-propyl]-3-methyl-butyramide::CHEMBL420606

SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)C(C)(C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(=O)NCC(N)=O

InChI Key InChIKey=HNNLSZAQRSQVDA-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 = 50059367   

TargetDelta-type opioid receptor(Rat)
National Institute of Environmental Health Sciences

Curated by ChEMBL
LigandPNGBDBM50059367((S)-2-[2-((S)-2-{(R)-2-[(S)-2-Amino-3-(4-hydroxy-p...)
Affinity DataKi:  0.200nMAssay Description:Affinity was assessed using competitive binding assay labeled with [3H]DPDPE (6.3 nM) for Opioid receptor delta 1More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetDelta-type opioid receptor(Mouse)
National Institute of Environmental Health Sciences

Curated by ChEMBL
LigandPNGBDBM50059367((S)-2-[2-((S)-2-{(R)-2-[(S)-2-Amino-3-(4-hydroxy-p...)
Affinity DataIC50: 0.360nMAssay Description:Functional biological activity for Opioid receptor delta 1 was determined in vitro, on mouse vas deferens (MVD).More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetMu-type opioid receptor(Rat)
National Institute of Environmental Health Sciences

Curated by ChEMBL
LigandPNGBDBM50059367((S)-2-[2-((S)-2-{(R)-2-[(S)-2-Amino-3-(4-hydroxy-p...)
Affinity DataKi:  0.430nMAssay Description:Affinity was assessed using competitive binding assay labeled with [3H]- DAGO (1.28 nM) for Opioid receptor mu 1More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetMu-type opioid receptor(Guinea pig)
National Institute of Environmental Health Sciences

Curated by ChEMBL
LigandPNGBDBM50059367((S)-2-[2-((S)-2-{(R)-2-[(S)-2-Amino-3-(4-hydroxy-p...)
Affinity DataIC50: 4.5nMAssay Description:Functional biological activity for mu opioid receptor was determined in vitro, on guinea pig ileum (GPI).More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed