Showing entry for Maxepa


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0000664
Compound NameMaxepa
Structure
FormulaC21H30O2
InchiKeyCYQFCXCEBYINGO-IAGOWNOFSA-N
SMILES[H][C@@]12C=C(C)CC[C@@]1([H])C(C)(C)OC1=CC(CCCCC)=CC(O)=C21
InchiInChI=1S/C21H30O2/c1-5-6-7-8-15-12-18(22)20-16-11-14(2)9-10-17(16)21(3,4)23-19(20)13-15/h11-13,16-17,22H,5-10H2,1-4H3/t16-,17-/m1/s1
IUPAC(6aR,10aR)-6,6,9-trimethyl-3-pentyl-6H,6aH,7H,8H,10aH-benzo[c]isochromen-1-ol
Molecular Weight314.46
Pubchem Id16078
Chembl IdCHEMBL465
Targets of Information Source
DrugBank DB00470
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 approved; illicit agonist
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 approved; illicit agonist
PDB TCI
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
P07148 BXGT006559 Fatty acid-binding protein, liver reviewed FABP1 - - - - -
Binding DB 60994
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
reviewed BXGT007836 Fatty acid-binding protein, liver reviewed Fabp1 1000 - - -
reviewed BXGT010582 Cannabinoid receptor 1 reviewed Cnr1 - - - 77
reviewed BXGT008556 Cannabinoid receptor 1 reviewed Cnr1 80 - - -
reviewed BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 32 - - -
reviewed BXGT008556 Cannabinoid receptor 1 reviewed Cnr1 67 - - -
reviewed BXGT008556 Cannabinoid receptor 1 reviewed Cnr1 - - - 11
reviewed BXGT008556 Cannabinoid receptor 1 reviewed Cnr1 - 5.8 - -
reviewed BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 36 - - -
reviewed BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 41 - - -
reviewed BXGT008556 Cannabinoid receptor 1 reviewed Cnr1 40 - - -
reviewed BXGT010599 Cannabinoid receptor 2 reviewed Cnr2 40 - - -
reviewed BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 10 - - -
reviewed BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 29 - - -
reviewed BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 25 - - -
reviewed BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 22 - - -
reviewed BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 46 - - -
reviewed BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 - - - 12
reviewed BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 - - - 78
reviewed BXGT008556 Cannabinoid receptor 1 reviewed Cnr1 41 - - -
reviewed BXGT008864 Glycine receptor subunit alpha-1 reviewed Ion channel GLRA1 - - - 1300
reviewed BXGT010582 Cannabinoid receptor 1 reviewed Cnr1 15 - - -
reviewed BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 42 - - -
reviewed BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 18 - - -
reviewed BXGT005128 Nuclear receptor subfamily 1 group I member 2 reviewed Nuclear receptor NR1I2 - - - 31600
reviewed BXGT005128 Nuclear receptor subfamily 1 group I member 2 reviewed Nuclear receptor NR1I2 - - - 12600
reviewed BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 17 - - -
reviewed BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 3.3 - - -
reviewed BXGT010599 Cannabinoid receptor 2 reviewed Cnr2 9.2 - - -
reviewed BXGT010582 Cannabinoid receptor 1 reviewed Cnr1 40 - - -
reviewed BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 41 - - -
reviewed BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 2.9 - - -
reviewed BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 - - - 1.5
reviewed BXGT008556 Cannabinoid receptor 1 reviewed Cnr1 36 - - -
reviewed BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 40 - - -
reviewed BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 40 - - -
reviewed BXGT008556 Cannabinoid receptor 1 reviewed Cnr1 - 218 - -
reviewed BXGT008556 Cannabinoid receptor 1 reviewed Cnr1 46 - - -
reviewed BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 - 2.8 - -
reviewed BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 - 9.5 - -
reviewed BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 - - - 17
reviewed BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 24 - - -
reviewed BXGT008556 Cannabinoid receptor 1 reviewed Cnr1 48 - - -
reviewed BXGT010599 Cannabinoid receptor 2 reviewed Cnr2 39 - - -
reviewed BXGT010582 Cannabinoid receptor 1 reviewed Cnr1 41 - - -
reviewed BXGT008556 Cannabinoid receptor 1 reviewed Cnr1 37 - - -
reviewed BXGT016509 Transient receptor potential cation channel subfamily A member 1 reviewed Trpa1 - - - 230
reviewed BXGT013461 N-arachidonyl glycine receptor reviewed G-protein coupled receptor GPR18 - - - 4610
reviewed BXGT022247 G-protein coupled receptor 55 reviewed G-protein coupled receptor GPR55 - 14200 - -
CHEMBL CHEMBL465
Uniport Id BXGT Id Protein Name Status Protein Class Gene width="10%">Type Relation value Units
Uniport Id BXGT Id Protein Name Status Protein Class Gene Type Relation value Units
P20272 BXGT008556 Cannabinoid receptor 1 reviewed - Cnr1 Ki '=' 41 nM
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 Ki '=' 42 nM
P20272 BXGT008556 Cannabinoid receptor 1 reviewed - Cnr1 Ki '=' 46 nM
Q9QZN9 BXGT021399 Cannabinoid receptor 2 reviewed - Cnr2 Ki '=' 46 nM
O75469 BXGT005128 Nuclear receptor subfamily 1 group I member 2 reviewed Nuclear receptor NR1I2 Efficacy '=' 79 %
P20272 BXGT008556 Cannabinoid receptor 1 reviewed - Cnr1 Ki '=' 66 nM
P47746 BXGT010582 Cannabinoid receptor 1 reviewed - Cnr1 Activity - - -
O75469 BXGT005128 Nuclear receptor subfamily 1 group I member 2 reviewed Nuclear receptor NR1I2 Efficacy '=' 60 %
P20272 BXGT008556 Cannabinoid receptor 1 reviewed - Cnr1 Ki '=' 39 nM
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 EC50 '=' 1 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 Ki '=' 40 nM
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 Ki '=' 41 nM
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 Ki '=' 36 nM
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 Ki '=' 71 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 Ki '=' 28 nM
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 Log Ki '=' 1 nM
P20272 BXGT008556 Cannabinoid receptor 1 reviewed - Cnr1 EC50 '=' 199 nM
P20272 BXGT008556 Cannabinoid receptor 1 reviewed - Cnr1 Emax '=' 159 %
P20272 BXGT008556 Cannabinoid receptor 1 reviewed - Cnr1 IC50 '=' 218 nM
Q9QZN9 BXGT021399 Cannabinoid receptor 2 reviewed - Cnr2 IC50 '=' 218 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 Log Ki '=' 1 nM
P47936 BXGT010599 Cannabinoid receptor 2 reviewed - Cnr2 Ki '=' 39 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 IC50 '=' 2 nM
P47936 BXGT010599 Cannabinoid receptor 2 reviewed - Cnr2 Ki '=' 9 nM
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 Ki '=' 24 nM
P47746 BXGT010582 Cannabinoid receptor 1 reviewed - Cnr1 Ki '=' 41 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 Emax '=' 20 %
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 21136 nM
Q6RI86 BXGT016509 Transient receptor potential cation channel subfamily A member 1 reviewed - Trpa1 EC50 '=' 230 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 Ki '=' 17 nM
O08914 BXGT004045 Fatty-acid amide hydrolase 1 reviewed - Faah Inhibition '=' 31 %
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 Ki '=' 32 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 EC50 '=' 17 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 Ki '=' 2 nM
P47746 BXGT010582 Cannabinoid receptor 1 reviewed - Cnr1 EC50 '=' 77 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 Ratio '=' 1 -
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 Ki '=' 10 nM
P47746 BXGT010582 Cannabinoid receptor 1 reviewed - Cnr1 Ki '=' 15 nM
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 Ki '=' 40 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 Ki '=' 18 nM
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 Inhibition '=' 21 %
P47746 BXGT010582 Cannabinoid receptor 1 reviewed - Cnr1 Ki '=' 40 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 Relative potency '=' 100 -
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 Relative potency '=' 100 -
P23415 BXGT008864 Glycine receptor subunit alpha-1 reviewed Ion channel GLRA1 Activity '=' 162 %
P20272 BXGT008556 Cannabinoid receptor 1 reviewed - Cnr1 Ki '=' 80 nM
P20272 BXGT008556 Cannabinoid receptor 1 reviewed - Cnr1 EC50 '=' 11 nM
P20272 BXGT008556 Cannabinoid receptor 1 reviewed - Cnr1 IC50 '=' 5 nM
O75762 BXGT005151 Transient receptor potential cation channel subfamily A member 1 reviewed Ion channel TRPA1 Activity '=' 10 uM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 Ki '=' 41 nM
P23415 BXGT008864 Glycine receptor subunit alpha-1 reviewed Ion channel GLRA1 EC50 '=' 1300 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 Ki '=' 40 nM
P20272 BXGT008556 Cannabinoid receptor 1 reviewed - Cnr1 Ki '=' 36 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 Ki '=' 22 nM
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 Ki '=' 3 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 Ki '=' 41 nM
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 Ki '=' 41 nM
P20272 BXGT008556 Cannabinoid receptor 1 reviewed - Cnr1 Ki '=' 37 nM
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 Ki '=' 25 nM
Q14330 BXGT013461 N-arachidonyl glycine receptor reviewed G-protein coupled receptor GPR18 EC50 '=' 4610 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 Ki '=' 3 nM
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 Ki '=' 46 nM
Q9Y2T6 BXGT022247 G-protein coupled receptor 55 reviewed G-protein coupled receptor GPR55 EC50 '=' 14200 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 EC50 '=' 77 nM
Q9R1A7 BXGT021413 Nuclear receptor subfamily 1 group I member 2 reviewed - Nr1i2 Activity - - -
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 EC50 '=' 12 nM
P47936 BXGT010599 Cannabinoid receptor 2 reviewed - Cnr2 Ki '=' 40 nM
Q9Y2T6 BXGT022247 G-protein coupled receptor 55 reviewed G-protein coupled receptor GPR55 IC50 '=' 14200 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 26608 nM
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 Ki '=' 36 nM
P23415 BXGT008864 Glycine receptor subunit alpha-1 reviewed Ion channel GLRA1 %max '=' 260 %
O75469 BXGT005128 Nuclear receptor subfamily 1 group I member 2 reviewed Nuclear receptor NR1I2 EC50 '=' 31600 nM
Q14330 BXGT013461 N-arachidonyl glycine receptor reviewed G-protein coupled receptor GPR18 EC50 '=' 960 nM
P20272 BXGT008556 Cannabinoid receptor 1 reviewed - Cnr1 IC50 '=' 5 nM
Q9QZN9 BXGT021399 Cannabinoid receptor 2 reviewed - Cnr2 IC50 '=' 5 nM
P20272 BXGT008556 Cannabinoid receptor 1 reviewed - Cnr1 Ki '=' 47 nM
O75469 BXGT005128 Nuclear receptor subfamily 1 group I member 2 reviewed Nuclear receptor NR1I2 Efficacy '=' 81 %
O75469 BXGT005128 Nuclear receptor subfamily 1 group I member 2 reviewed Nuclear receptor NR1I2 EC50 '=' 12600 nM
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 IC50 '=' 9 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 Ki '=' 39 nM
P35462 BXGT009835 D(3) dopamine receptor reviewed G-protein coupled receptor DRD3 EC50 '=' 10 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00817 Fishes Aquatic foods
BXGF05853 Cannabis sativa Cannabis sativa Medicinal Plant
The  compound-realted  diseases
Diseases
BXGD Id Disease Name CUI Disease Id Disease Class Name Number of targets?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease