BDBM50343253 CHEMBL1773748::Dimethyl 5-((2S,4aR,6aR,7R,9S,10aS,10bR)-9-acetoxy-7-(methoxycarbonyl)-6a,10b-dimethyl-4,10-dioxododecahydro-1H-benzo[f]isochromen-2-yl)-7-oxabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylate

SMILES COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@@H](C[C@]21C)C1=CC2OC1C(C(=O)OC)=C2C(=O)OC

InChI Key

Data  3 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 3 hits for monomerid = 50343253   

TargetKappa-type opioid receptor(Human)
University of Iowa

Curated by ChEMBL
LigandPNGBDBM50343253(Dimethyl 5-((2S,4aR,6aR,7R,9S,10aS,10bR)-9-acetoxy...)
Affinity DataKi:  60nMAssay Description:Displacement of [3H]U69593 from kappa opioid receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2011
Entry Details Article
PubMed
TargetMu-type opioid receptor(Human)
University of Iowa

Curated by ChEMBL
LigandPNGBDBM50343253(Dimethyl 5-((2S,4aR,6aR,7R,9S,10aS,10bR)-9-acetoxy...)
Affinity DataKi: >4.80E+3nMAssay Description:Agonist activity at mu opioid receptor assessed as stimulation of [35S]GTPgammaS bindingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2011
Entry Details Article
PubMed
TargetDelta-type opioid receptor(Human)
University of Iowa

Curated by ChEMBL
LigandPNGBDBM50343253(Dimethyl 5-((2S,4aR,6aR,7R,9S,10aS,10bR)-9-acetoxy...)
Affinity DataKi: >5.00E+3nMAssay Description:Displacement of [3H]DADLE from delta opioid receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2011
Entry Details Article
PubMed