Showing entry for Afzelin



                             
General Compound Information
BXGC IdBXGC0013974
Compound NameAfzelin
Structure
FormulaC21H20O10
InchiKeySOSLMHZOJATCCP-AEIZVZFYSA-N
SMILESOc1ccc(cc1)c1oc2cc(O)cc(c2c(=O)c1O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O)O
InchiInChI=1S/C21H20O10/c1-8-15(25)17(27)18(28)21(29-8)31-20-16(26)14-12(24)6-11(23)7-13(14)30-19(20)9-2-4-10(22)5-3-9/h2-8,15,17-18,21-25,27-28H,1H3/t8-,15-,17+,18+,21-/m0/s1
IUPAC5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one
Molecular Weight432.11
Pubchem Id5316673
Chembl IdCHEMBL240528
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 AFE
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
P18654 BXGT008418 Ribosomal protein S6 kinase alpha-3 reviewed Rps6ka3 - - - - -
Binding DB n.a
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
CHEMBL CHEMBL240528
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
P29477 BXGT009355 Nitric oxide synthase, inducible reviewed - Nos2 IC50 '>' 50000 nM
P10635 BXGT007595 Cytochrome P450 2D6 reviewed - CYP2D6 IC50 '>' 100000 nM
O42713 BXGT004563 Polyphenol oxidase 2 reviewed - PPO2 IC50 '>' 400000 nM
P98170 BXGT012231 E3 ubiquitin-protein ligase XIAP reviewed Enzyme modulator XIAP IC50 '>' 100000 nM
P08684 BXGT006812 Cytochrome P450 3A4 reviewed Enzyme CYP3A4 IC50 '>' 100000 nM
Q76353 BXGT016849 Integrase unreviewed - IC50 '>' 100 ug.mL-1
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00073 Japanese persimmon Diospyros kaki Fruits
BXGF00076 Loquat Eriobotrya japonica Fruits
BXGF00128 Passion fruit Passiflora edulis Fruits
BXGF00224 Rambutan Nephelium lappaceum Fruits
BXGF00928 Pteris australis Pteris australis Others
BXGF00989 Asteriscus aquaticus Asteriscus aquaticus Others
BXGF01018 Cinnamomum subavenium Cinnamomum subavenium Medicinal Plant
BXGF01031 Epimedium sagittatum Epimedium sagittatum Medicinal Plant
BXGF01032 Osmorhiza aristata Osmorhiza aristata Medicinal Plant
BXGF01083 Elymus repens Elymus repens Medicinal Plant
BXGF01102 Pseudowintera colorata Pseudowintera colorata Others
BXGF01111 Hymenidium lindleyanum Hymenidium lindleyanum Others
BXGF01121 Litsea salicifolia Litsea salicifolia Human Edible Plant
BXGF01126 Polygonum cuspidatum Polygonum cuspidatum Medicinal Plant
BXGF01162 Stipa vaseyi Stipa vaseyi Others
BXGF01180 Phebalium dentatum Phebalium dentatum Others
BXGF01217 Ecballium elaterium Ecballium elaterium Medicinal Plant
BXGF01222 Ocimum tenuiflorum Ocimum tenuiflorum Medicinal Plant
BXGF01242 Capparis ovata Capparis ovata Medicinal Plant
BXGF01244 Croton montevidensis Croton montevidensis Others
BXGF01254 Petrorhagia dubia Petrorhagia dubia Others
BXGF01309 Ajuga genevensis Ajuga genevensis Garden Plant
BXGF01313 Cleistopholis staudtii Cleistopholis staudtii Others
BXGF01327 Datisca glomerata Datisca glomerata Others
BXGF01374 Balanops australiana Balanops australiana Others
BXGF01378 Quercus imbricaria Quercus imbricaria Medicinal Plant
BXGF01382 Zingiber aromaticum Zingiber aromaticum Medicinal Plant
BXGF01397 Euphorbia sieboldiana Euphorbia sieboldiana Medicinal Plant
BXGF01409 Dioscorea olfersiana Dioscorea olfersiana Human Edible Plant
BXGF01430 Leuzea centauroides Leuzea centauroides Others
BXGF01444 Cassine papillosa Cassine papillosa Human Edible Plant
BXGF01488 Cyrtomium falcatum Cyrtomium falcatum Medicinal Plant
BXGF01609 Epimedium sempervirens Epimedium sempervirens Others
BXGF01678 Nepeta multifida Nepeta multifida Others
BXGF01702 Eremostachys moluccelloides Eremostachys moluccelloides Others
BXGF01711 Hypericum mysorense Hypericum mysorense Medicinal Plant
BXGF01713 Cucumis myriocarpus Cucumis myriocarpus Medicinal Plant
BXGF01802 Kandelia candel Kandelia candel Medicinal Plant
BXGF01823 Houttuynia cordata Houttuynia cordata Medicinal Plant
BXGF02012 Glochidion sphaerogynum Glochidion sphaerogynum Medicinal Plant
BXGF02187 Boronia pinnata Boronia pinnata Others
BXGF02223 Aconitum gigas Aconitum gigas Others
BXGF02370 Epimedium pubescens Epimedium pubescens Medicinal Plant
BXGF02435 Pinguicula vulgaris Pinguicula vulgaris Medicinal Plant
BXGF02504 Senecio dolichodoryius Senecio dolichodoryius Others
BXGF02505 Pinus sylvestris Pinus sylvestris Medicinal Plant
BXGF02530 Ceanothus sanguineus Ceanothus sanguineus Medicinal Plant
BXGF02561 Dysosma versipellis Dysosma versipellis Medicinal Plant
BXGF02620 Rosa chinensis Rosa chinensis Medicinal Plant
BXGF02654 Guarea trichilioides Guarea trichilioides Others
BXGF02707 Leontopodium nanum Leontopodium nanum Others
BXGF02736 Larix decidua Larix decidua Medicinal Plant
BXGF02802 Araiostegiella perdurans Araiostegiella perdurans Others
BXGF02829 Strophanthus preussii Strophanthus preussii Others
BXGF02868 Sideritis nutans Sideritis nutans Others
BXGF02874 Tadehagi triquetrum Tadehagi triquetrum Medicinal Plant
BXGF02881 Epimedium grandiflorum Epimedium grandiflorum Medicinal Plant
BXGF02946 Artemisia anomala Artemisia anomala Medicinal Plant
BXGF02960 Vicia benghalensis Vicia benghalensis Agricultural Plant
BXGF02987 Pycnandra acuminata Pycnandra acuminata Others
BXGF03051 Phyllanthus oligospermus Phyllanthus oligospermus Others
BXGF03070 Callerya cinerea Callerya cinerea Human Edible Plant
BXGF03101 Psychotria serpens Psychotria serpens Medicinal Plant
BXGF03233 Plinia cauliflora Plinia cauliflora Medicinal Plant
BXGF03337 Acer carpinifolium Acer carpinifolium Medicinal Plant
BXGF03350 Tarenaya spinosa Tarenaya spinosa Medicinal Plant
BXGF03404 Hippocratea excelsa Hippocratea excelsa Medicinal Plant
BXGF03443 Morinda morindoides Morinda morindoides Human Edible Plant
BXGF03476 Hylocomium splendens Hylocomium splendens Others
BXGF03497 Excoecaria agallocha Excoecaria agallocha Medicinal Plant
BXGF03542 Angylocalyx braunii Angylocalyx braunii Others
BXGF03583 Epimedium koreanum Epimedium koreanum Medicinal Plant
BXGF03592 Wedelia scaberrima Wedelia scaberrima Others
BXGF03646 Carlina acanthifolia Carlina acanthifolia Medicinal Plant
BXGF03656 Tripterygium regelii Tripterygium regelii Medicinal Plant
BXGF03677 Cynoglossum germanicum Cynoglossum germanicum Others
BXGF03707 Reseda luteola Reseda luteola Medicinal Plant
BXGF03763 Millettia laurentii Millettia laurentii Medicinal Plant
BXGF03765 Alcea rosea Alcea rosea Medicinal Plant
BXGF03810 Osmanthus heterophyllus Osmanthus heterophyllus Others
BXGF03816 Stachyurus himalaicus Stachyurus himalaicus Others
BXGF04081 Maytenus hookeri Maytenus hookeri Medicinal Plant
BXGF04088 Aster ageratoides Aster ageratoides Human Edible Plant
BXGF04108 Delphinium cashmerianum Delphinium cashmerianum Medicinal Plant
BXGF04118 Thaminophyllum multiflorum Thaminophyllum multiflorum Others
BXGF04127 Tephrosia pumila Tephrosia pumila Medicinal Plant
BXGF04137 Senecio rupestris Senecio rupestris Others
BXGF04143 Vitis silvestris Vitis silvestris Others
BXGF04148 Pluchea suaveolens Pluchea suaveolens Others
BXGF04152 Mussaenda parviflora Mussaenda parviflora Others
BXGF04153 Solanum andigena Solanum andigena Others
BXGF04157 Hypericum revolutum Hypericum revolutum Medicinal Plant
BXGF04160 Pilocarpus spicatus Pilocarpus spicatus Others
BXGF04166 Walsura tubulata Walsura tubulata Others
BXGF04169 Anisodus tanguticus Anisodus tanguticus Medicinal Plant
BXGF04183 Tephrosia vogelii Tephrosia vogelii Medicinal Plant
BXGF04195 Panax papyrifer Panax papyrifer Others
BXGF04200 Euphorbia hirta Euphorbia hirta Medicinal Plant
BXGF04218 Heuchera cylindrica Heuchera cylindrica Medicinal Plant
BXGF04223 Amelanchier vulgaris Amelanchier vulgaris Others
BXGF04242 Prunus lusitanica Prunus lusitanica Medicinal Plant
BXGF04291 Calea pilosa Calea pilosa Others
BXGF04307 Stevia connata Stevia connata Others
BXGF04330 Helichrysum davenportii Helichrysum davenportii Others
BXGF04335 Plectranthus purpuratus Plectranthus purpuratus Others
BXGF04344 Cineraria geifolia Cineraria geifolia Others
BXGF04349 Monodora tenuifolia Monodora tenuifolia Human Edible Plant
BXGF04353 Halocarpus biformis Halocarpus biformis Others
BXGF04397 Iochroma australe Iochroma australe Others
BXGF04798 Ranunculus acris Ranunculus acris Medicinal Plant
BXGF04881 Fallopia multiflora Fallopia multiflora Medicinal Plant
BXGF04896 Kokoona reflexa Kokoona reflexa Others
BXGF04969 Xylopia brasiliensis Xylopia brasiliensis Others
BXGF05069 Piper sanctum Piper sanctum Human Edible Plant
BXGF05078 Alstonia undulifolia Alstonia undulifolia Others
BXGF05083 Viguiera decurrens Viguiera decurrens Medicinal Plant
BXGF05116 Uncaria guianensis Uncaria guianensis Medicinal Plant
BXGF05123 Ilex hainanensis Ilex hainanensis Others
BXGF05143 Scrophularia koelzii Scrophularia koelzii Medicinal Plant
BXGF05145 Sideritis brevibracteata Sideritis brevibracteata Human Edible Plant
BXGF05184 Maesa ramentacea Maesa ramentacea Medicinal Plant
BXGF05191 Artemisia mesatlantica Artemisia mesatlantica Others
BXGF05198 Archidendron lucidum Archidendron lucidum Others
BXGF05222 Veronica persica Veronica persica Medicinal Plant
BXGF05225 Betula platyphylla Betula platyphylla Medicinal Plant
BXGF05242 Euphorbia cornigera Euphorbia cornigera Others
BXGF05253 Canarium album Canarium album Medicinal Plant
BXGF05256 Scabiosa succisa Scabiosa succisa Medicinal Plant
BXGF05283 Polygonum flaccidum Polygonum flaccidum Medicinal Plant
BXGF05317 Melicope sarcococca Melicope sarcococca Others
BXGF05334 Helleborus multifidus Helleborus multifidus Others
BXGF05368 Salvia yosgadensis Salvia yosgadensis Others
BXGF05370 Epimedium brevicornu Epimedium brevicornu Others
BXGF05378 Hubertia tomentosa Hubertia tomentosa Others
BXGF05393 Ekebergia senegalensis Ekebergia senegalensis Others
BXGF05396 Daphne oleoides Daphne oleoides Medicinal Plant
BXGF05403 Dipteryx odorata Dipteryx odorata Medicinal Plant
BXGF05406 Tsuga diversifolia Tsuga diversifolia Others
BXGF05428 Sideroxylon cubense Sideroxylon cubense Others
BXGF05435 Dorycnium hirsutum Dorycnium hirsutum Others
BXGF05453 Ligustrum obtusifolium Ligustrum obtusifolium Medicinal Plant
BXGF05496 Chrysocoma peduncularis Chrysocoma peduncularis Others
BXGF05541 Helichrysum auriceps Helichrysum auriceps Others
BXGF05547 Morus rubra Morus rubra Medicinal Plant
BXGF05623 Mesembryanthemum expansum Mesembryanthemum expansum Medicinal Plant
BXGF05633 Pongamiopsis pervilleana Pongamiopsis pervilleana Others
BXGF05642 Echinacea pallida Echinacea pallida Medicinal Plant
BXGF05654 Pinus strobus Pinus strobus Medicinal Plant
BXGF05655 Clematis angustifolia Clematis angustifolia Human Edible Plant
BXGF05730 Alpinia blepharocalyx Alpinia blepharocalyx Medicinal Plant
BXGF05734 Artemisia ludoviciana subsp. mexicana Artemisia ludoviciana subsp. mexicana Medicinal Plant
BXGF05737 Galium dasypodum Galium dasypodum Others
BXGF05764 Eucalyptus jenseni Eucalyptus jenseni Others
BXGF05769 Vismia orientalis Vismia orientalis Medicinal Plant
BXGF05783 Phebalium ambiens Phebalium ambiens Others
BXGF05807 Brachychiton populneum Brachychiton populneum Others
BXGF05869 Salacia lehmbachii Salacia lehmbachii Medicinal Plant
BXGF05871 Fagus fusca Fagus fusca Others
BXGF05889 Spiracantha cornifolia Spiracantha cornifolia Others
BXGF05924 Helichrysum lepidissimum Helichrysum lepidissimum Medicinal Plant
BXGF05928 Cleistanthus indochinensis Cleistanthus indochinensis Others
BXGF05930 Passiflora foetida Passiflora foetida Medicinal Plant
BXGF05942 Austrocedrus chilensis Austrocedrus chilensis Medicinal Plant
BXGF05952 Tylophora tanakae Tylophora tanakae Others
BXGF05954 Pluchea odorata Pluchea odorata Others
BXGF05973 Stenomesson miniatum Stenomesson miniatum Others
BXGF06031 Myristica cagayanensis Myristica cagayanensis Others
BXGF06033 Euonymus tingens Euonymus tingens Medicinal Plant
BXGF06060 Hopea utilis Hopea utilis Medicinal Plant
BXGF06082 Narthecium asiaticum Narthecium asiaticum Others
BXGF06161 Epimedium wushanense Epimedium wushanense Medicinal Plant
BXGF06216 Vernonia anisochaetoides Vernonia anisochaetoides Others
BXGF06236 Charpentiera obovata Charpentiera obovata Others
BXGF06262 Vernonanthura pinguis Vernonanthura pinguis Others
BXGF06270 Lotus ucrainicus Lotus ucrainicus 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