BDBM50189920 (S)-2-amino-N-((S)-2-(2-(benzylamino)-2-oxoethyl)-3-oxo-2,3,4,5-tetrahydro-1H-benzo[c]azepin-4-yl)-3-(4-hydroxy-2,6-dimethylphenyl)propanamide::CHEMBL208683::H-Dmt-Aba-Gly-NH-CH2-Ph

SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)NCc2ccccc2)C1=O

InChI Key InChIKey=HAQFBGNRXYPSQF-UHFFFAOYSA-N

Data  4 KI  4 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 8 hits for monomerid = 50189920   

TargetMu-type opioid receptor(Guinea pig)
Vrije Universiteit Brussel

Curated by ChEMBL
LigandPNGBDBM50189920(H-Dmt-Aba-Gly-NH-CH2-Ph | (S)-2-amino-N-((S)-2-(2-...)
Affinity DataIC50: 51nMAssay Description:Agonist activity at mu opioid receptor in Hartley guinea pig assessed as inhibition of electrically evoked ileum contraction by GPI testMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetDelta-type opioid receptor(Mouse)
Vrije Universiteit Brussel

Curated by ChEMBL
LigandPNGBDBM50189920(H-Dmt-Aba-Gly-NH-CH2-Ph | (S)-2-amino-N-((S)-2-(2-...)
Affinity DataIC50: 830nMAssay Description:Agonist activity at delta opioid receptor in mouse assessed as inhibition of electrically evoked vas-deferens contraction by MVD testMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetDelta-type opioid receptor(Mouse)
Vrije Universiteit Brussel

Curated by ChEMBL
LigandPNGBDBM50189920(H-Dmt-Aba-Gly-NH-CH2-Ph | (S)-2-amino-N-((S)-2-(2-...)
Affinity DataIC50: 830nMAssay Description:Agonist activity at delta opioid receptor by mouse vas deferens assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/7/2012
Entry Details Article
PubMed
TargetMu-type opioid receptor(Guinea pig)
Vrije Universiteit Brussel

Curated by ChEMBL
LigandPNGBDBM50189920(H-Dmt-Aba-Gly-NH-CH2-Ph | (S)-2-amino-N-((S)-2-(2-...)
Affinity DataIC50: 51nMAssay Description:Agonist activity at mu opioid receptor by guinea pig ileum assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/7/2012
Entry Details Article
PubMed
TargetMu-type opioid receptor(Rat)
Vrije Universiteit Brussel

Curated by ChEMBL
LigandPNGBDBM50189920(H-Dmt-Aba-Gly-NH-CH2-Ph | (S)-2-amino-N-((S)-2-(2-...)
Affinity DataKi:  0.460nMAssay Description:Displacement of [3H]DAMGO from mu opioid receptor in Sprague-Dawley rat brain synaptosomal membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetMu-type opioid receptor(Human)
Vrije Universiteit Brussels

Curated by ChEMBL
LigandPNGBDBM50189920(H-Dmt-Aba-Gly-NH-CH2-Ph | (S)-2-amino-N-((S)-2-(2-...)
Affinity DataKi:  0.460nMAssay Description:Binding affinity to mu opioid receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/7/2012
Entry Details Article
PubMed
TargetDelta-type opioid receptor(Human)
Vrije Universiteit Brussels

Curated by ChEMBL
LigandPNGBDBM50189920(H-Dmt-Aba-Gly-NH-CH2-Ph | (S)-2-amino-N-((S)-2-(2-...)
Affinity DataKi:  11nMAssay Description:Binding affinity to delta opioid receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/7/2012
Entry Details Article
PubMed
TargetDelta-type opioid receptor(Rat)
Vrije Universiteit Brussel

Curated by ChEMBL
LigandPNGBDBM50189920(H-Dmt-Aba-Gly-NH-CH2-Ph | (S)-2-amino-N-((S)-2-(2-...)
Affinity DataKi:  11nMAssay Description:Displacement of [3H]DPDPE from delta opioid receptor in Sprague-Dawley rat brain synaptosomal membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed