BDBM50266388 (2S,4aR,6aR,7R,9S,10aS,10bR)-methyl 9-acetoxy-2-(ethoxymethyl)-6a,10b-dimethyl-4,10-dioxododecahydro-1H-benzo[f]isochromene-7-carboxylate::CHEMBL458869::US8492564, 10

SMILES CCOC[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=CQXGRDFAMBLQBY-UHFFFAOYSA-N

Data  4 KI  1 EC50

  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 5 hits for monomerid = 50266388   

TargetKappa-type opioid receptor(Human)
Mclean Hospital

Curated by ChEMBL
LigandPNGBDBM50266388(US8492564, 10 | CHEMBL458869 | (2S,4aR,6aR,7R,9S,1...)
Affinity DataEC50: >1.00E+3nMAssay Description:Agonist activity at human KOPR expressed in CHO cells assessed as enhancement of [35S]GTPgammaS bindingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetKappa-type opioid receptor(Human)
Mclean Hospital

Curated by ChEMBL
LigandPNGBDBM50266388(US8492564, 10 | CHEMBL458869 | (2S,4aR,6aR,7R,9S,1...)
Affinity DataKi:  497nMAssay Description:In vitro binding assay: The affinities of compounds for opioid receptors were determined by competitive inhibition of [3H]diprenorphine binding to ka...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/28/2013
Entry Details
Go to US Patent

TargetKappa-type opioid receptor(Human)
Mclean Hospital

Curated by ChEMBL
LigandPNGBDBM50266388(US8492564, 10 | CHEMBL458869 | (2S,4aR,6aR,7R,9S,1...)
Affinity DataKi:  497nMAssay Description:Displacement of [3H]diprenorphine from human KOPR expressed in CHO cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetMu-type opioid receptor(Rat)
Mclean Hospital

Curated by ChEMBL
LigandPNGBDBM50266388(US8492564, 10 | CHEMBL458869 | (2S,4aR,6aR,7R,9S,1...)
Affinity DataKi: >1.00E+3nMAssay Description:Binding affinity to rat MOPR expressed in CHO cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetDelta-type opioid receptor(Mouse)
Mclean Hospital

Curated by ChEMBL
LigandPNGBDBM50266388(US8492564, 10 | CHEMBL458869 | (2S,4aR,6aR,7R,9S,1...)
Affinity DataKi: >1.00E+3nMAssay Description:Binding affinity to mouse DOPR expressed in CHO cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed