Showing entry for Myricitrin


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0050184
Compound NameMyricitrin
Structure
FormulaC21H20O12
InchiKeyDCYOADKBABEMIQ-OWMUPTOHSA-N
SMILESOc1cc(O)c2c(c1)oc(c(c2=O)O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O)c1cc(O)c(c(c1)O)O
InchiInChI=1S/C21H20O12/c1-6-14(26)17(29)18(30)21(31-6)33-20-16(28)13-9(23)4-8(22)5-12(13)32-19(20)7-2-10(24)15(27)11(25)3-7/h2-6,14,17-18,21-27,29-30H,1H3/t6-,14-,17+,18+,21-/m0/s1
IUPAC5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one
Molecular Weight464.1
Pubchem Id5281673
Chembl IdCHEMBL522983
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 153266
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 BXGT019667 Aurora kinase B reviewed Kinase AURKB - 3890 - -
CHEMBL CHEMBL522983
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
Q9NR56 BXGT021179 Muscleblind-like protein 1 reviewed Nucleic acid binding MBNL1 Potency - 12589 nM
Q9XUB2 BXGT022194 Zinc finger protein mex-5 reviewed - mex-5 EC50 '=' 14047 nM
Q13951 BXGT013407 Core-binding factor subunit beta reviewed - CBFB Potency - 28183 nM
Q01196 BXGT012575 Runt-related transcription factor 1 reviewed Transcription factor RUNX1 Potency - 28183 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency '=' 891 nM
Q9UIF8 BXGT021718 Bromodomain adjacent to zinc finger domain protein 2B reviewed - BAZ2B Potency - 50118 nM
P07237 BXGT006576 Protein disulfide-isomerase reviewed - P4HB AC50 '=' 9800 nM
P10253 BXGT007550 Lysosomal alpha-glucosidase reviewed Enzyme GAA Potency '=' 3162 nM
O75164 BXGT005104 Lysine-specific demethylase 4A reviewed - KDM4A Potency - 31622 nM
Q9UNA4 BXGT021785 DNA polymerase iota reviewed - POLI Potency - 75193 nM
Q9UNA4 BXGT021785 DNA polymerase iota reviewed - POLI Potency - 50118 nM
P53350 BXGT010984 Serine/threonine-protein kinase PLK1 reviewed Kinase PLK1 Potency - 37685 nM
Q9Y253 BXGT022216 DNA polymerase eta reviewed - POLH Potency - 39810 nM
Q57TT1 BXGT015153 Uncharacterized protein unreviewed - Tb927.8.6820 Potency - 50118 nM
O97447 BXGT005436 Putative fructose-1,6-bisphosphate aldolase unreviewed - ald Potency '=' 5000 nM
Q9F4F7 BXGT020344 4'-phosphopantetheinyl transferase ffp reviewed - ffp Potency '=' 56234 nM
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 17782 nM
P39748 BXGT010134 Flap endonuclease 1 reviewed Enzyme FEN1 Potency - 2238 nM
Q9UBT6 BXGT021664 DNA polymerase kappa reviewed - POLK Potency - 1683 nM
P83916 BXGT012025 Chromobox protein homolog 1 reviewed Epigenetic regulator CBX1 Potency - 8912 nM
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 15848 nM
P46063 BXGT010501 ATP-dependent DNA helicase Q1 reviewed Enzyme RECQL Potency '=' 28183 nM
Q13526 BXGT013369 Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 reviewed - PIN1 Potency - 39810 nM
P27695 BXGT009199 DNA-(apurinic or apyrimidinic site) lyase reviewed - APEX1 Potency - 14125 nM
B2RXH2 BXGT002006 Lysine-specific demethylase 4E reviewed - KDM4E Potency '=' 2238 nM
P06746 BXGT006496 DNA polymerase beta reviewed Enzyme POLB Potency '=' 10000 nM
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 3548 nM
P00352 BXGT005510 Retinal dehydrogenase 1 reviewed Enzyme ALDH1A1 Potency '=' 25118 nM
Q9F4F7 BXGT020344 4'-phosphopantetheinyl transferase ffp reviewed - ffp Potency '=' 31622 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 29092 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 23109 nM
O97447 BXGT005436 Putative fructose-1,6-bisphosphate aldolase unreviewed - ald Potency '=' 15811 nM
P27695 BXGT009199 DNA-(apurinic or apyrimidinic site) lyase reviewed - APEX1 Potency - 10000 nM
P07237 BXGT006576 Protein disulfide-isomerase reviewed - P4HB AC50 - 9800 nM
P9WH09 BXGT012284 dTDP-4-dehydrorhamnose reductase reviewed - rmlD Inhibition - - -
Q13951 BXGT013407 Core-binding factor subunit beta reviewed - CBFB Potency - 25118 nM
Q01196 BXGT012575 Runt-related transcription factor 1 reviewed Transcription factor RUNX1 Potency - 25118 nM
G5EF15 BXGT003524 Cytoplasmic zinc-finger protein unreviewed - pos-1 EC50 '=' 15805 nM
P39748 BXGT010134 Flap endonuclease 1 reviewed Enzyme FEN1 Potency - 3013 nM
Q99700 BXGT019949 Ataxin-2 reviewed Nucleic acid binding ATXN2 Potency - 35481 nM
P34949 BXGT009775 Mannose-6-phosphate isomerase reviewed Enzyme MPI IC50 '=' 30965 nM
Q96KQ7 BXGT019687 Histone-lysine N-methyltransferase EHMT2 reviewed Epigenetic regulator EHMT2 Potency - 44668 nM
Q9UBT6 BXGT021664 DNA polymerase kappa reviewed - POLK Potency - 25118 nM
O94925 BXGT005342 Glutaminase kidney isoform, mitochondrial reviewed Enzyme GLS Potency - 15848 nM
P86926 BXGT012095 RNA-editing ligase 1, mitochondrial reviewed - REL1 IC50 '=' 51381 nM
P23467 BXGT008869 Receptor-type tyrosine-protein phosphatase beta reviewed - PTPRB Kis '>' 125 uM
O95398 BXGT005378 Rap guanine nucleotide exchange factor 3 reviewed Enzyme modulator RAPGEF3 Potency - 89125 nM
P05067 BXGT006306 Amyloid-beta precursor protein reviewed Enzyme modulator APP Inhibition '=' 62 %
O42713 BXGT004563 Polyphenol oxidase 2 reviewed - PPO2 IC50 '=' 120000 nM
O42713 BXGT004563 Polyphenol oxidase 2 reviewed - PPO2 IC50 '=' 320000 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00183 Common thyme Thymus vulgaris Herbs and Spices
BXGF00432 Sesbania flower Sesbania bispinosa Vegetables
BXGF00729 Shea tree Vitellaria paradoxa Herbs and Spices
BXGF00878 Lespedeza bicolor Lespedeza bicolor Medicinal Plant
BXGF01043 Acanthospermum glabratum Acanthospermum glabratum Medicinal Plant
BXGF01083 Elymus repens Elymus repens Medicinal Plant
BXGF01142 Arum alpinum Arum alpinum Others
BXGF01208 Angelica lucida Angelica lucida Human Edible Plant
BXGF01229 Strophanthus kombe Strophanthus kombe Medicinal Plant
BXGF01271 Castanea vesca Castanea vesca Others
BXGF01309 Ajuga genevensis Ajuga genevensis Garden Plant
BXGF01488 Cyrtomium falcatum Cyrtomium falcatum Medicinal Plant
BXGF01513 Rhododendron farrerae Rhododendron farrerae Others
BXGF01626 Nerine bowdenii Nerine bowdenii Others
BXGF01630 Cotula cinerea Cotula cinerea Medicinal Plant
BXGF01706 Daphniphyllum paxianum Daphniphyllum paxianum Others
BXGF01754 Cryptotaenia japonica Cryptotaenia japonica Medicinal Plant
BXGF01933 Piptocarpha oblonga Piptocarpha oblonga Others
BXGF02012 Glochidion sphaerogynum Glochidion sphaerogynum Medicinal Plant
BXGF02137 Goniothalamus amuyon Goniothalamus amuyon Medicinal Plant
BXGF02187 Boronia pinnata Boronia pinnata Others
BXGF02322 Gardenia turgida Gardenia turgida Medicinal Plant
BXGF02363 Rhododendron luteum Rhododendron luteum Others
BXGF02400 Hylotelephium telephium Hylotelephium telephium Medicinal Plant
BXGF02435 Pinguicula vulgaris Pinguicula vulgaris Medicinal Plant
BXGF02773 Carica pennata Carica pennata Others
BXGF03109 Cneoridium dumosum Cneoridium dumosum Others
BXGF03131 Astragalus cibarius Astragalus cibarius Medicinal Plant
BXGF03178 Cryptocarya alba Cryptocarya alba Human Edible Plant
BXGF03205 Veratrum dahuricum Veratrum dahuricum Others
BXGF03219 Hymenoxys insignis Hymenoxys insignis Others
BXGF03291 Vernonia menthaefolia Vernonia menthaefolia Others
BXGF03350 Tarenaya spinosa Tarenaya spinosa Medicinal Plant
BXGF03353 Aconitum heterophylloides Aconitum heterophylloides Others
BXGF03361 Alyxia reinwardtii Alyxia reinwardtii Medicinal Plant
BXGF03362 Stereospermum cylindricum Stereospermum cylindricum Medicinal Plant
BXGF03404 Hippocratea excelsa Hippocratea excelsa Medicinal Plant
BXGF03461 Microtropis fokienensis Microtropis fokienensis Others
BXGF03658 Centaurea linifolia Centaurea linifolia Others
BXGF03726 Serratula inermis Serratula inermis Others
BXGF03804 Machilus macrantha Machilus macrantha Medicinal Plant
BXGF03832 Alangium grisolleoides Alangium grisolleoides Others
BXGF03866 Toxicodendron succedaneum Toxicodendron succedaneum Medicinal Plant
BXGF03899 Litsea triflora Litsea triflora Others
BXGF04080 Persicaria orientalis Persicaria orientalis Medicinal Plant
BXGF04200 Euphorbia hirta Euphorbia hirta Medicinal Plant
BXGF04345 Uvaria griffithii Uvaria griffithii Others
BXGF04564 Ephedra equisetina Ephedra equisetina Medicinal Plant
BXGF04607 Morus alba Morus alba Medicinal Plant
BXGF04736 Capnoides sempervirens Capnoides sempervirens Others
BXGF04953 Polygonum aviculare Polygonum aviculare Medicinal Plant
BXGF05154 Bunias orientalis Bunias orientalis Medicinal Plant
BXGF05195 Limonium sinense Limonium sinense Others
BXGF05266 Rhododendron ellipticum Rhododendron ellipticum Others
BXGF05322 Trichosanthes rosthornii Trichosanthes rosthornii Medicinal Plant
BXGF05389 Limonium gmelinii Limonium gmelinii Medicinal Plant
BXGF05502 Globularia davisiana Globularia davisiana Others
BXGF05522 Solidago serotina Solidago serotina Others
BXGF05633 Pongamiopsis pervilleana Pongamiopsis pervilleana Others
BXGF05689 Artemisia klotzchiana Artemisia klotzchiana Others
BXGF05696 Zephyranthes sulphurea Zephyranthes sulphurea Others
BXGF05732 Mimusops caffra Mimusops caffra Human Edible Plant
BXGF05838 Zanthoxylum fagara Zanthoxylum fagara Human Edible Plant
BXGF05928 Cleistanthus indochinensis Cleistanthus indochinensis Others
BXGF05942 Austrocedrus chilensis Austrocedrus chilensis Medicinal Plant
BXGF05967 Veronica arvensis Veronica arvensis Medicinal Plant
BXGF06005 Ilex lepta Ilex lepta Others
BXGF06167 Sorbaria sorbifolia Sorbaria sorbifolia Medicinal Plant
BXGF06169 Catunaregam spinosa Catunaregam spinosa Medicinal Plant
BXGF06183 Adina sessilifolia Adina sessilifolia Others
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