Showing entry for Cannabinol


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0021403
Compound NameCannabinol
Structure
FormulaC21H26O2
InchiKeyVBGLYOIFKLUMQG-UHFFFAOYSA-N
SMILESCCCCCc1cc(O)c2c(c1)OC(c1c2cc(C)cc1)(C)C
InchiInChI=1S/C21H26O2/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/h9-13,22H,5-8H2,1-4H3
IUPAC6,6,9-trimethyl-3-pentylbenzo[c]chromen-1-ol
Molecular Weight310.19
Pubchem Id2543
Chembl IdCHEMBL74415
Targets of Information Source
DrugBank n.a
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
PDB n.a
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
Binding DB 50061117
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 BXGT021402 Sigma non-opioid intracellular receptor 1 reviewed Sigmar1 >10000 - - -
reviewed BXGT008556 Cannabinoid receptor 1 reviewed Cnr1 308 - - -
reviewed BXGT008556 Cannabinoid receptor 1 reviewed Cnr1 - - - 120
reviewed BXGT008556 Cannabinoid receptor 1 reviewed Cnr1 211 - - -
reviewed BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 126 - - -
reviewed BXGT008556 Cannabinoid receptor 1 reviewed Cnr1 392.2 - - -
reviewed BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 - - - 261.2
reviewed BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 96 - - -
reviewed BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 308 - - -
CHEMBL CHEMBL74415
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
O08914 BXGT004045 Fatty-acid amide hydrolase 1 reviewed - Faah Inhibition '=' 46 %
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 16788 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 Log Ki '=' 2 nM
P20272 BXGT008556 Cannabinoid receptor 1 reviewed - Cnr1 EC50 '=' 316 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 Ki '=' 308 nM
P20272 BXGT008556 Cannabinoid receptor 1 reviewed - Cnr1 Ki '=' 211 nM
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 EC50 '=' 261 nM
P04798 BXGT006265 Cytochrome P450 1A1 reviewed Enzyme CYP1A1 Ki '=' 541 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 Relative potency '=' 0 -
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 Relative potency '=' 0 -
P20272 BXGT008556 Cannabinoid receptor 1 reviewed - Cnr1 Ki '=' 392 nM
P20272 BXGT008556 Cannabinoid receptor 1 reviewed - Cnr1 EC50 '=' 120 nM
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 Log Ki '=' 1 nM
P20272 BXGT008556 Cannabinoid receptor 1 reviewed - Cnr1 Emax '=' 131 %
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 Ki '=' 96 nM
Q8R455 BXGT018684 Transient receptor potential cation channel subfamily M member 8 reviewed - Trpm8 IC50 '=' 210 nM
P05177 BXGT006336 Cytochrome P450 1A2 reviewed Enzyme CYP1A2 Ki '=' 79 nM
Q6RI86 BXGT016509 Transient receptor potential cation channel subfamily A member 1 reviewed - Trpa1 EC50 '=' 180 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 9441 nM
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 Ki '=' 126 nM
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 Activity '=' 10 %
Q9ERZ8 BXGT020313 Transient receptor potential cation channel subfamily V member 4 reviewed - Trpv4 EC50 '=' 16100 nM
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 EC50 '=' 73 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 Activity '=' 10 %
Q8NER1 BXGT018556 Transient receptor potential cation channel subfamily V member 1 reviewed Ion channel TRPV1 EC50 '=' 6200 nM
Q16678 BXGT013656 Cytochrome P450 1B1 reviewed Enzyme CYP1B1 Ki '=' 148 nM
E9PU00 BXGT026162 Transient receptor potential cation channel, subfamily V, member 3 unreviewed - Trpv3 EC50 '=' 5300 nM
Q9WUD2 BXGT021939 Transient receptor potential cation channel subfamily V member 2 reviewed - Trpv2 EC50 '=' 19000 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 EC50 '=' 75 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
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