BDBM50266390 (2S,4aR,6aR,7R,9S,10aS,10bR)-methyl 9-acetoxy-6a,10b-dimethyl-4,10-dioxo-2-(thiophene-2-carbonyl)dodecahydro-1H-benzo[f]isochromene-7-carboxylate::CHEMBL458870::US8492564, 13

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)C(=O)c1cccs1

InChI Key InChIKey=BUZATHRTYONYQM-UHFFFAOYSA-N

Data  7 KI  2 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 9 hits for monomerid = 50266390   

TargetKappa-type opioid receptor(Human)
The University of Kansas

Curated by ChEMBL
LigandPNGBDBM50266390(US8492564, 13 | CHEMBL458870 | (2S,4aR,6aR,7R,9S,1...)
Affinity DataKi:  36nMAssay Description:Displacement of [3H]U69593 from human recombinant kappa opioid receptor expressed in CHO cells after 2 hrs by liquid scintillation countingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/7/2013
Entry Details Article
PubMed
TargetKappa-type opioid receptor(Human)
The University of Kansas

Curated by ChEMBL
LigandPNGBDBM50266390(US8492564, 13 | CHEMBL458870 | (2S,4aR,6aR,7R,9S,1...)
Affinity DataKi:  38nMAssay 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
TargetKappa-type opioid receptor(Human)
The University of Kansas

Curated by ChEMBL
LigandPNGBDBM50266390(US8492564, 13 | CHEMBL458870 | (2S,4aR,6aR,7R,9S,1...)
Affinity DataKi:  38nMAssay 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
US Patent

TargetKappa-type opioid receptor(Human)
The University of Kansas

Curated by ChEMBL
LigandPNGBDBM50266390(US8492564, 13 | CHEMBL458870 | (2S,4aR,6aR,7R,9S,1...)
Affinity DataEC50:  101nMAssay 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
TargetMu-type opioid receptor(Rat)
Mclean Hospital

Curated by ChEMBL
LigandPNGBDBM50266390(US8492564, 13 | CHEMBL458870 | (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
LigandPNGBDBM50266390(US8492564, 13 | CHEMBL458870 | (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
TargetKappa-type opioid receptor(Human)
The University of Kansas

Curated by ChEMBL
LigandPNGBDBM50266390(US8492564, 13 | CHEMBL458870 | (2S,4aR,6aR,7R,9S,1...)
Affinity DataEC50:  1.63E+3nMAssay Description:Agonist activity at human recombinant kappa opioid receptor expressed in CHO cells assessed as [35S]GTP-gamma-S binding after 3 hrs by liquid scintil...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/7/2013
Entry Details Article
PubMed
TargetDelta-type opioid receptor(Human)
The University of Kansas

Curated by ChEMBL
LigandPNGBDBM50266390(US8492564, 13 | CHEMBL458870 | (2S,4aR,6aR,7R,9S,1...)
Affinity DataKi: >1.00E+4nMAssay Description:Displacement of [3H]DADLE from human recombinant delta opioid receptor expressed in CHO cells after 2 hrs by liquid scintillation countingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/7/2013
Entry Details Article
PubMed
TargetMu-type opioid receptor(Human)
The University of Kansas

Curated by ChEMBL
LigandPNGBDBM50266390(US8492564, 13 | CHEMBL458870 | (2S,4aR,6aR,7R,9S,1...)
Affinity DataKi: >1.00E+4nMAssay Description:Displacement of [3H]DAMGO from human recombinant mu opioid receptor expressed in CHO cells after 2 hrs by liquid scintillation countingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/7/2013
Entry Details Article
PubMed