Showing entry for Magnolol


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0038577
Compound NameMagnolol
Structure
FormulaC18H18O2
InchiKeyVVOAZFWZEDHOOU-UHFFFAOYSA-N
SMILESC=CCc1ccc(c(c1)c1cc(CC=C)ccc1O)O
InchiInChI=1S/C18H18O2/c1-3-5-13-7-9-17(19)15(11-13)16-12-14(6-4-2)8-10-18(16)20/h3-4,7-12,19-20H,1-2,5-6H2
IUPAC2-(2-hydroxy-5-prop-2-enylphenyl)-4-prop-2-enylphenol
Molecular Weight266.13
Pubchem Id72300
Chembl IdCHEMBL180920
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 MLO
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
P19793 BXGT008515 Retinoic acid receptor RXR-alpha reviewed RXRA Nuclear receptor - - - -
P37231 BXGT009972 Peroxisome proliferator-activated receptor gamma reviewed PPARG Nuclear receptor - - 1670 -
Binding DB 78304
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 BXGT012099 Mitochondrial import inner membrane translocase subunit TIM10 reviewed TIM10 - 68300 - -
reviewed BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 >2000 - - -
reviewed BXGT008061 Gamma-aminobutyric acid receptor subunit alpha-1 reviewed Ion channel GABRA1 - - - 36800
reviewed BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 1440 - - -
reviewed BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 3150 - - -
reviewed BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 - - - 18300
reviewed BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 - - - 3280
CHEMBL CHEMBL180920
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
P00352 BXGT005510 Retinal dehydrogenase 1 reviewed Enzyme ALDH1A1 Potency '=' 39810 nM
Q9Y2T6 BXGT022247 G-protein coupled receptor 55 reviewed G-protein coupled receptor GPR55 Kb - - -
Q77YF9 BXGT016886 Protein Vpr unreviewed - vpr Potency - 63095 nM
P10253 BXGT007550 Lysosomal alpha-glucosidase reviewed Enzyme GAA Potency '=' 31622 nM
Q8R431 BXGT018683 Monoglyceride lipase reviewed - Mgll Inhibition - - -
P47870 BXGT010591 Gamma-aminobutyric acid receptor subunit beta-2 reviewed Ion channel GABRB2 Smax '=' 963 %
P14867 BXGT008061 Gamma-aminobutyric acid receptor subunit alpha-1 reviewed Ion channel GABRA1 Smax '=' 963 %
Q9GZV3 BXGT020427 High affinity choline transporter 1 reviewed Transporter SLC5A7 IC50 - 2886 nM
Q03431 BXGT012714 Parathyroid hormone/parathyroid hormone-related peptide receptor reviewed G-protein coupled receptor PTH1R Potency - 89125 nM
Q03164 BXGT012700 Histone-lysine N-methyltransferase 2A reviewed - KMT2A Potency '=' 25118 nM
O00255 BXGT003903 Menin reviewed - MEN1 Potency '=' 25118 nM
P84022 BXGT012027 Mothers against decapentaplegic homolog 3 reviewed Transcription factor SMAD3 Potency - 35481 nM
O42275 BXGT004559 Acetylcholinesterase reviewed - ache Inhibition '=' -2 %
Q9GZV3 BXGT020427 High affinity choline transporter 1 reviewed Transporter SLC5A7 IC50 - 1703 nM
Q6W5P4 BXGT016588 Neuropeptide S receptor reviewed - NPSR1 Potency '=' 12589 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 EC50 '=' 18300 nM
Q8WZA2 BXGT019025 Rap guanine nucleotide exchange factor 4 reviewed Enzyme modulator RAPGEF4 Potency - 50118 nM
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 28183 nM
Q962Y6 BXGT019597 Thioredoxin glutathione reductase unreviewed - TGR Potency '=' 56234 nM
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 Ki '=' 1440 nM
P47870 BXGT010591 Gamma-aminobutyric acid receptor subunit beta-2 reviewed Ion channel GABRB2 Activity '=' 357 %
P14867 BXGT008061 Gamma-aminobutyric acid receptor subunit alpha-1 reviewed Ion channel GABRA1 Activity '=' 357 %
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 22387 nM
P03433 BXGT006070 Polymerase acidic protein reviewed - PA Inhibition '=' - -
Q9Z1B7 BXGT022403 Mitogen-activated protein kinase 13 reviewed - Mapk13 Inhibition - - -
Q9WUI1 BXGT021940 Mitogen-activated protein kinase 11 reviewed - Mapk11 Inhibition - - -
O08911 BXGT004043 Mitogen-activated protein kinase 12 reviewed - Mapk12 Inhibition - - -
P47811 BXGT010587 Mitogen-activated protein kinase 14 reviewed - Mapk14 Inhibition - - -
P02791 BXGT005965 Ferritin light chain reviewed - FTL Potency '=' 15848 nM
P47870 BXGT010591 Gamma-aminobutyric acid receptor subunit beta-2 reviewed Ion channel GABRB2 EC50 '=' 36800 nM
P14867 BXGT008061 Gamma-aminobutyric acid receptor subunit alpha-1 reviewed Ion channel GABRA1 EC50 '=' 36800 nM
Q13148 BXGT013318 TAR DNA-binding protein 43 reviewed - TARDBP Potency - 35481 nM
B2RXH2 BXGT002006 Lysine-specific demethylase 4E reviewed - KDM4E Potency '=' 28183 nM
Q03164 BXGT012700 Histone-lysine N-methyltransferase 2A reviewed - KMT2A Potency '=' 17782 nM
O00255 BXGT003903 Menin reviewed - MEN1 Potency '=' 17782 nM
P49286 BXGT010691 Melatonin receptor type 1B reviewed G-protein coupled receptor MTNR1B Activity '=' 20 %
P51450 BXGT010847 Nuclear receptor ROR-gamma reviewed - Rorc Potency '=' 28183 nM
O75496 BXGT005132 Geminin reviewed - GMNN Potency - 9200 nM
Q194T2 BXGT013743 Non-structural protein 1 unreviewed - NS1 Potency '=' 11220 nM
Q96KQ7 BXGT019687 Histone-lysine N-methyltransferase EHMT2 reviewed Epigenetic regulator EHMT2 Potency - 15848 nM
P43220 BXGT010367 Glucagon-like peptide 1 receptor reviewed G-protein coupled receptor GLP1R Potency - 11220 nM
P02791 BXGT005965 Ferritin light chain reviewed - FTL Potency '=' 25118 nM
P15428 BXGT008121 15-hydroxyprostaglandin dehydrogenase [NAD(+)] reviewed - HPGD Potency '=' 31622 nM
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 562 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 20596 nM
P51450 BXGT010847 Nuclear receptor ROR-gamma reviewed - Rorc Potency '=' 17782 nM
P68400 BXGT011599 Casein kinase II subunit alpha reviewed Kinase CSNK2A1 Kd - - -
P67870 BXGT011566 Casein kinase II subunit beta reviewed Kinase CSNK2B Kd - - -
P02791 BXGT005965 Ferritin light chain reviewed - FTL Potency '=' 17782 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 14581 nM
P81908 BXGT011959 Cholinesterase reviewed - BCHE Inhibition '=' 0 %
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 EC50 '=' 3280 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 Efficacy '=' 62 %
P87108 BXGT012099 Mitochondrial import inner membrane translocase subunit TIM10 reviewed - TIM10 IC50 '=' 68300 nM
Q99700 BXGT019949 Ataxin-2 reviewed Nucleic acid binding ATXN2 Potency - 18887 nM
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 Ki '=' 3150 nM
P97612 BXGT012211 Fatty-acid amide hydrolase 1 reviewed - Faah Inhibition - - -
O15296 BXGT004148 Arachidonate 15-lipoxygenase B reviewed Enzyme ALOX15B Potency - 31622 nM
P48039 BXGT010607 Melatonin receptor type 1A reviewed G-protein coupled receptor MTNR1A Activity '=' 40 %
Q9Y2T6 BXGT022247 G-protein coupled receptor 55 reviewed G-protein coupled receptor GPR55 Inhibition '=' 0 %
P34972 BXGT009779 Cannabinoid receptor 2 reviewed G-protein coupled receptor CNR2 Efficacy '=' 31 %
P09874 BXGT006934 Poly [ADP-ribose] polymerase 1 reviewed - PARP1 Kd - - -
Q9H2K2 BXGT020454 Poly [ADP-ribose] polymerase tankyrase-2 reviewed - TNKS2 Kd - - -
O95271 BXGT005369 Poly [ADP-ribose] polymerase tankyrase-1 reviewed - TNKS Kd - - -
Q9H8M2 BXGT020495 Bromodomain-containing protein 9 reviewed Epigenetic regulator BRD9 Activity - - -
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00090 Star anise Illicium verum Herbs and Spices
BXGF00397 Colorado pinyon Pinus edulis Nuts
BXGF00459 Wax gourd Benincasa hispida Gourds
BXGF00863 Pyrus bourgaeana Pyrus bourgaeana Human Edible Plant
BXGF01020 Baccharis truncata Baccharis truncata Others
BXGF01101 Ononis viscosa Ononis viscosa Others
BXGF01192 Cuphea hyssopifolia Cuphea hyssopifolia Human Edible Plant
BXGF01237 Magnolia obovata Magnolia obovata Medicinal Plant
BXGF01259 Illicium difengpi Illicium difengpi Medicinal Plant
BXGF01394 Holarrhena floribunda Holarrhena floribunda Medicinal Plant
BXGF01565 Farfugium japonicum Farfugium japonicum Medicinal Plant
BXGF01600 Sedum sarmentosum Sedum sarmentosum Medicinal Plant
BXGF01628 Salvia broussonetii Salvia broussonetii Others
BXGF01656 Eria rigida Eria rigida Others
BXGF01687 Magnolia liliiflora Magnolia liliiflora Others
BXGF01691 Gynoxys verrucosa Gynoxys verrucosa Others
BXGF01843 Triunia erythrocarpa Triunia erythrocarpa Others
BXGF01984 Chloranthus fortunei Chloranthus fortunei Others
BXGF02007 Sandoricum koetjape Sandoricum koetjape Medicinal Plant
BXGF02033 Suaeda maritima Suaeda maritima Medicinal Plant
BXGF02058 Pedicularis rex Pedicularis rex Others
BXGF02409 Euphorbia palustris Euphorbia palustris Medicinal Plant
BXGF02451 Sorbus torminalis Sorbus torminalis Medicinal Plant
BXGF02759 Magnolia biondii Magnolia biondii Medicinal Plant
BXGF03158 Rheum officinale Rheum officinale Medicinal Plant
BXGF03583 Epimedium koreanum Epimedium koreanum Medicinal Plant
BXGF03957 Centaurea benedicta Centaurea benedicta Medicinal Plant
BXGF03988 Rheum coreanum Rheum coreanum Others
BXGF04069 Posidonia oceanica Posidonia oceanica Others
BXGF04381 Chuquiraga erinacea Chuquiraga erinacea Others
BXGF04539 Rheum palmatum Rheum palmatum Medicinal Plant
BXGF04542 Streblus asper Streblus asper Medicinal Plant
BXGF04970 Magnolia liliflora Magnolia liliflora Medicinal Plant
BXGF05099 Alpinia flabellata Alpinia flabellata Medicinal Plant
BXGF05249 Fouquieria diguetii Fouquieria diguetii Others
BXGF05264 Magnolia officinalis Magnolia officinalis Medicinal Plant
BXGF05701 Euphorbia pithyusa Euphorbia pithyusa Others
BXGF05877 Rheum tanguticum Rheum tanguticum Medicinal Plant
BXGF05915 Fritillaria hupehensis Fritillaria hupehensis Medicinal Plant
BXGF06026 Magnolia officinalis rehd et wils Magnolia officinalis rehd et wils Others
BXGF06054 Angelica japonica Angelica japonica Medicinal Plant
BXGF06158 Lathyrus latifolius Lathyrus latifolius Medicinal Plant
BXGF06244 Pterocarpus erinaceus Pterocarpus erinaceus 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