BDBM50343257 CHEMBL1773752::Diethyl 4-((2S,4aR,6aR,7R,9S,10aS,10bR)-9-acetoxy-7-(methoxycarbonyl)-6a,10b-dimethyl-4,10-dioxododecahydro-1H-benzo[f]isochromen-2-yl)phthalate

SMILES CCOC(=O)c1ccc(cc1C(=O)OCC)[C@@H]1C[C@@]2(C)[C@@H](CC[C@@]3(C)[C@@H](C[C@H](OC(C)=O)C(=O)[C@H]23)C(=O)OC)C(=O)O1

InChI Key InChIKey=YBRXYXZMDSIZKV-UHFFFAOYSA-N

Data  3 KI

  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 3 hits for monomerid = 50343257   

TargetKappa-type opioid receptor(Human)
University of Iowa

Curated by ChEMBL
LigandPNGBDBM50343257(Diethyl 4-((2S,4aR,6aR,7R,9S,10aS,10bR)-9-acetoxy-...)
Affinity DataKi:  228nMAssay 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
LigandPNGBDBM50343257(Diethyl 4-((2S,4aR,6aR,7R,9S,10aS,10bR)-9-acetoxy-...)
Affinity DataKi: >3.00E+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
LigandPNGBDBM50343257(Diethyl 4-((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