BDBM50121331 22-cyclopropylmethyl-2-ethoxy-13-methyl-(2S,13R)-14-oxa-11,22-diazaheptacyclo[13.9.1.01,13.02,21.04,12.05,10.019,25]pentacosa-4(12),5(10),6,8,15,17,19(25)-heptaen-16-ol::Naltrindole analogue

SMILES CCO[C@]12Cc3c([nH]c4ccccc34)[C@]3(C)Oc4c5c(CC1N(CC1CC1)CCC235)ccc4O

InChI Key

Data  6 KI

  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 6 hits for monomerid = 50121331   

TargetDelta-type opioid receptor(Human)
University of Innsbruck

Curated by ChEMBL
LigandPNGBDBM50121331(22-cyclopropylmethyl-2-ethoxy-13-methyl-(2S,13R)-1...)
Affinity DataKi:  0.960nMAssay Description:The ability of compound to inhibit [35S]GTP-delta-S binding in guinea pig caudate stimulated by SNC80 (Opioid receptor delta 1) antagonistMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/27/2012
Entry Details Article
PubMed
TargetDelta-type opioid receptor(Rat)
University of Innsbruck

Curated by ChEMBL
LigandPNGBDBM50121331(22-cyclopropylmethyl-2-ethoxy-13-methyl-(2S,13R)-1...)
Affinity DataKi:  4.40nMAssay Description:Binding affinity at delta opioid receptor 1 in rat brain membrane by [3H]DADLE displacement.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/27/2012
Entry Details Article
PubMed
TargetKappa-type opioid receptor(Guinea pig)
University of Innsbruck

Curated by ChEMBL
LigandPNGBDBM50121331(22-cyclopropylmethyl-2-ethoxy-13-methyl-(2S,13R)-1...)
Affinity DataKi:  134nMAssay Description:Binding affinity at kappa opioid receptor 1 in guinea pig brain by [3H]U-69593 displacement.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/27/2012
Entry Details Article
PubMed
TargetMu-type opioid receptor(Rat)
University of Innsbruck

Curated by ChEMBL
LigandPNGBDBM50121331(22-cyclopropylmethyl-2-ethoxy-13-methyl-(2S,13R)-1...)
Affinity DataKi:  340nMAssay Description:Binding affinity at mu opioid receptor 1 in rat brain membrane by [3H]DAMGO displacement.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/27/2012
Entry Details Article
PubMed
TargetKappa-type opioid receptor(Guinea pig)
University of Innsbruck

Curated by ChEMBL
LigandPNGBDBM50121331(22-cyclopropylmethyl-2-ethoxy-13-methyl-(2S,13R)-1...)
Affinity DataKi: >1.00E+4nMAssay Description:The ability of compound to inhibit [35S]GTP-delta-S binding in guinea pig caudate stimulated by U69,593 (Opioid receptor kappa 1) antagonistMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/27/2012
Entry Details Article
PubMed
TargetMu-type opioid receptor(Guinea pig)
University of Innsbruck

Curated by ChEMBL
LigandPNGBDBM50121331(22-cyclopropylmethyl-2-ethoxy-13-methyl-(2S,13R)-1...)
Affinity DataKi: >1.00E+4nMAssay Description:The ability of compound to inhibit [35S]GTP-delta-S binding in guinea pig caudate stimulated by DAMGO (Opioid receptor mu 1) antagonistMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/27/2012
Entry Details Article
PubMed