BDBM113765 (E)-N-Allyl-6-((1R,2R)-3,3-dimethyl-2-(3-methylbut-3-enyl)cyclobutyl)hepta-2,6-dienamide (11b)

SMILES CC(=C)CC[C@@H]1[C@@H](CC1(C)C)C(=C)CC\C=C\C(=O)NCC=C

InChI Key InChIKey=HCJKJGVLSCAUCC-UHFFFAOYSA-N

Data  2 KI  3 IC50

  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 = 113765   

TargetFatty-acid amide hydrolase 1(Human)
University of Bern

LigandPNGBDBM113765((E)-N-Allyl-6-((1R,2R)-3,3-dimethyl-2-(3-methylbut...)
Affinity DataIC50: 2.70E+3nMpH: 7.6 T: 2°CAssay Description:In this assay, 0.05 Units of hFAAH was pre-incubated for 30 min at 37 C with 2 uL of 11a, 11b, 11f at different concentrations (0.01 - 100 uM) or veh...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/7/2014
Entry Details Article
PubMed
TargetProstaglandin G/H synthase 2(Human)
University of Bern

LigandPNGBDBM113765((E)-N-Allyl-6-((1R,2R)-3,3-dimethyl-2-(3-methylbut...)
Affinity DataIC50: 5.00E+4nMpH: 8.0 T: 2°CAssay Description:Tested compounds (50 uM), DuP-597 (0.5 uM; positive control), 11f and 11eie(1 nM - 200 uM ) or vehicle were pre-incubated with COX-FIS assay buffer (...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/7/2014
Entry Details Article
PubMed
TargetProstaglandin G/H synthase 2(Human)
University of Bern

LigandPNGBDBM113765((E)-N-Allyl-6-((1R,2R)-3,3-dimethyl-2-(3-methylbut...)
Affinity DataIC50: 5.00E+4nMpH: 8.0 T: 2°CAssay Description:Tested compounds (50 uM), DuP-597 (0.5 uM; positive control), 11f and 11eie(1 nM - 200 uM ) or vehicle were pre-incubated with COX-FIS assay buffer (...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/7/2014
Entry Details Article
PubMed
TargetCannabinoid receptor 2(Human)
University of Bern

LigandPNGBDBM113765((E)-N-Allyl-6-((1R,2R)-3,3-dimethyl-2-(3-methylbut...)
Affinity DataKi:  680nM ΔG°:  -8.55kcal/molepH: 7.4 T: 2°CAssay Description:In this assay, 18 ug of crude membrane expressing hCB1 or hCB2 receptors were re-suspended in 300 uL of binding buffer containing 50 mM Tris-HCl, 2.5...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/7/2014
Entry Details Article
PubMed
TargetCannabinoid receptor 1(Human)
University of Bern

LigandPNGBDBM113765((E)-N-Allyl-6-((1R,2R)-3,3-dimethyl-2-(3-methylbut...)
Affinity DataKi:  8.64E+3nM ΔG°:  -7.02kcal/molepH: 7.4 T: 2°CAssay Description:In this assay, 18 ug of crude membrane expressing hCB1 or hCB2 receptors were re-suspended in 300 uL of binding buffer containing 50 mM Tris-HCl, 2.5...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/7/2014
Entry Details Article
PubMed