null

SMILES CCCNC(=O)\C=C\CCC(=C)[C@@H]1CC(C)(C)[C@@H]1CCC(C)=C

InChI Key InChIKey=GCFYIBSBKKEKSL-AYLUNBTKSA-N

  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 5 hits for monomerid = 113764   

TargetCannabinoid receptor 2(Homo sapiens (Human))
University of Bern , Bühlstrasse 28, CH-3012 Bern, Switzerland.

LigandPNGBDBM113764((E)-6-((1R,2R)-3,3-Dimethyl-2-(3-methylbut-3-enyl)...)copy SMILEScopy InChI
Affinity DataKi:  1.01E+3nM ΔG°:  -8.31kcal/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 DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2T15295PubMed
TargetCannabinoid receptor 1(Homo sapiens (Human))
University of Bern , Bühlstrasse 28, CH-3012 Bern, Switzerland.

LigandPNGBDBM113764((E)-6-((1R,2R)-3,3-Dimethyl-2-(3-methylbut-3-enyl)...)copy SMILEScopy InChI
Affinity DataKi:  3.66E+3nM ΔG°:  -7.54kcal/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 DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2T15295PubMed
TargetProstaglandin G/H synthase 2(Homo sapiens (Human))
University of Bern , Bühlstrasse 28, CH-3012 Bern, Switzerland.

LigandPNGBDBM113764((E)-6-((1R,2R)-3,3-Dimethyl-2-(3-methylbut-3-enyl)...)copy SMILEScopy InChI
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 DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2T15295PubMed
TargetProstaglandin G/H synthase 2(Homo sapiens (Human))
University of Bern , Bühlstrasse 28, CH-3012 Bern, Switzerland.

LigandPNGBDBM113764((E)-6-((1R,2R)-3,3-Dimethyl-2-(3-methylbut-3-enyl)...)copy SMILEScopy InChI
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 DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2T15295PubMed
TargetFatty-acid amide hydrolase 1(Homo sapiens (Human))
University of Bern , Bühlstrasse 28, CH-3012 Bern, Switzerland.

LigandPNGBDBM113764((E)-6-((1R,2R)-3,3-Dimethyl-2-(3-methylbut-3-enyl)...)copy SMILEScopy InChI
Affinity DataIC50: 6.30E+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 DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2T15295PubMed