BDBM50037133 (4aR,7aR,12bS)-9-Hydroxy-3-methyl-2,3,4,4a,5,6-hexahydro-1H-8-oxa-3-aza-benzo[d]fluoren-7-one::CHEMBL324418

SMILES CN1CC[C@@]23[C@@H](Oc4c2cccc4O)C(=O)CC[C@H]3C1

InChI Key InChIKey=FYULEOKOSVDLQX-UHFFFAOYSA-N

Data  4 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 4 hits for monomerid = 50037133   

TargetMu-type opioid receptor(Guinea pig)
National Taiwan University

Curated by ChEMBL
LigandPNGBDBM50037133((4aR,7aR,12bS)-9-Hydroxy-3-methyl-2,3,4,4a,5,6-hex...)
Affinity DataKi:  7.80nMAssay Description:In vivo binding affinity against mu opioid receptor was measured by using labeled ligand [3H]naloxone (0.5 nM)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetDelta-type opioid receptor(Human)
National Taiwan University

Curated by ChEMBL
LigandPNGBDBM50037133((4aR,7aR,12bS)-9-Hydroxy-3-methyl-2,3,4,4a,5,6-hex...)
Affinity DataKi:  84nMAssay Description:In vivo binding affinity against delta Opioid receptor was measured by using labeled ligand [3H]DADLE (1 nM) with 4 nM sufentanilMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetKappa-type opioid receptor(Guinea pig)
National Taiwan University

Curated by ChEMBL
LigandPNGBDBM50037133((4aR,7aR,12bS)-9-Hydroxy-3-methyl-2,3,4,4a,5,6-hex...)
Affinity DataKi:  186nMAssay Description:In vivo binding affinity against kappa opioid receptor was measured by using labeled ligand [3H]ethylketocyclazocine (1 nM) with 500 nM DADLE and 20 ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetSigma non-opioid intracellular receptor 1(Human)
National Taiwan University

Curated by ChEMBL
LigandPNGBDBM50037133((4aR,7aR,12bS)-9-Hydroxy-3-methyl-2,3,4,4a,5,6-hex...)
Affinity DataKi:  2.09E+3nMAssay Description:In vivo binding affinity against sigma Opioid receptor was measured by using labeled ligand [3H]-SKF- 10,047 (1 nM)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed