Showing entry for Aloeemodin


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0002061
Compound NameAloeemodin
Structure
FormulaC15H10O5
InchiKeyYDQWDHRMZQUTBA-UHFFFAOYSA-N
SMILESOCC1=CC2=C(C(O)=C1)C(=O)C1=C(C=CC=C1O)C2=O
InchiInChI=1S/C15H10O5/c16-6-7-4-9-13(11(18)5-7)15(20)12-8(14(9)19)2-1-3-10(12)17/h1-5,16-18H,6H2
IUPAC1,8-dihydroxy-3-(hydroxymethyl)-9,10-dihydroanthracene-9,10-dione
Molecular Weight270.24
Pubchem Id10207
Chembl IdCHEMBL40275
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 50085551
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 BXGT008148 Intestinal-type alkaline phosphatase 1 reviewed Alpi - 2880 - -
reviewed BXGT006942 Intestinal-type alkaline phosphatase reviewed Enzyme ALPI - >100000 - -
reviewed BXGT007603 Alkaline phosphatase, germ cell type reviewed Enzyme ALPG - >100000 - -
reviewed BXGT006338 Alkaline phosphatase, tissue-nonspecific isozyme reviewed Enzyme ALPL - >100000 - -
reviewed BXGT008751 Acetylcholinesterase reviewed Enzyme ACHE - 18 - -
reviewed BXGT009770 Bifunctional epoxide hydrolase 2 reviewed Enzyme EPHX2 - 26800 - -
reviewed BXGT009770 Bifunctional epoxide hydrolase 2 reviewed Enzyme EPHX2 52200 - - -
reviewed BXGT007927 Aldehyde dehydrogenase, cytosolic 1 reviewed Aldh1a7 - 6000 - -
reviewed BXGT005293 Thioredoxin reductase 1, cytoplasmic reviewed Txnrd1 - 180000 - -
reviewed BXGT022399 Thioredoxin reductase 2, mitochondrial reviewed Txnrd2 - >200000 - -
reviewed BXGT020448 P2Y purinoceptor 12 reviewed G-protein coupled receptor P2RY12 >10000 - - -
CHEMBL CHEMBL40275
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
P08311 BXGT006762 Cathepsin G reviewed Enzyme CTSG Inhibition '=' 3 %
P24822 BXGT008996 Intestinal-type alkaline phosphatase reviewed - Iap IC50 '=' 2880 nM
P05186 BXGT006338 Alkaline phosphatase, tissue-nonspecific isozyme reviewed Enzyme ALPL IC50 '>' 100000 nM
P80457 BXGT011911 Xanthine dehydrogenase/oxidase reviewed - XDH Inhibition '=' 22 %
P08419 BXGT006770 Chymotrypsin-like elastase family member 2A reviewed - CELA2A Inhibition '=' 18 %
Q9Z0J5 BXGT022399 Thioredoxin reductase 2, mitochondrial reviewed - Txnrd2 IC50 '>' 200000 nM
P09923 BXGT006942 Intestinal-type alkaline phosphatase reviewed Enzyme ALPI IC50 '>' 100000 nM
P13601 BXGT007927 Aldehyde dehydrogenase, cytosolic 1 reviewed - Aldh1a7 IC50 '=' 6000 nM
P0C6X7 BXGT007440 Replicase polyprotein 1ab reviewed - rep IC50 '=' 132000 nM
P03372 BXGT006059 Estrogen receptor reviewed Nuclear receptor ESR1 Control '=' 99 %
Q92731 BXGT019366 Estrogen receptor beta reviewed Nuclear receptor ESR2 Control '=' 99 %
Q9H244 BXGT020448 P2Y purinoceptor 12 reviewed G-protein coupled receptor P2RY12 Ki '>' 10000 nM
P00533 BXGT005575 Epidermal growth factor receptor reviewed Kinase EGFR Activity - - -
P22303 BXGT008751 Acetylcholinesterase reviewed Enzyme ACHE Inhibition '=' 70 %
P39748 BXGT010134 Flap endonuclease 1 reviewed Enzyme FEN1 Potency - 50118 nM
O95149 BXGT005350 Snurportin-1 reviewed - SNUPN Potency - 31622 nM
Q14974 BXGT013516 Importin subunit beta-1 reviewed Transporter KPNB1 Potency - 31622 nM
P62826 BXGT011463 GTP-binding nuclear protein Ran reviewed Enzyme modulator RAN Potency - 31622 nM
P43220 BXGT010367 Glucagon-like peptide 1 receptor reviewed G-protein coupled receptor GLP1R Potency - 28183 nM
Q9UNA4 BXGT021785 DNA polymerase iota reviewed - POLI Potency - 19952 nM
P03372 BXGT006059 Estrogen receptor reviewed Nuclear receptor ESR1 Potency - 19952 nM
P34913 BXGT009770 Bifunctional epoxide hydrolase 2 reviewed Enzyme EPHX2 Inhibition '=' 79 %
P08246 BXGT006756 Neutrophil elastase reviewed Enzyme ELANE Inhibition '=' 21 %
O42275 BXGT004559 Acetylcholinesterase reviewed - ache Inhibition '=' 14 %
P00766 BXGT005647 Chymotrypsinogen A reviewed - Inhibition '=' 13 %
P03372 BXGT006059 Estrogen receptor reviewed Nuclear receptor ESR1 Control '=' 102 %
Q92731 BXGT019366 Estrogen receptor beta reviewed Nuclear receptor ESR2 Control '=' 102 %
Q9H244 BXGT020448 P2Y purinoceptor 12 reviewed G-protein coupled receptor P2RY12 Inhibition '=' 2 %
Q03164 BXGT012700 Histone-lysine N-methyltransferase 2A reviewed - KMT2A Potency '=' 7079 nM
O00255 BXGT003903 Menin reviewed - MEN1 Potency '=' 7079 nM
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 Potency - 34376 nM
P16234 BXGT008209 Platelet-derived growth factor receptor alpha reviewed Kinase PDGFRA Activity - - -
P09619 BXGT006911 Platelet-derived growth factor receptor beta reviewed Kinase PDGFRB Activity - - -
P03372 BXGT006059 Estrogen receptor reviewed Nuclear receptor ESR1 Control '<' 126 %
Q92731 BXGT019366 Estrogen receptor beta reviewed Nuclear receptor ESR2 Control '<' 126 %
P22303 BXGT008751 Acetylcholinesterase reviewed Enzyme ACHE Inhibition - - -
P81908 BXGT011959 Cholinesterase reviewed - BCHE Inhibition '=' 0 %
O89049 BXGT005293 Thioredoxin reductase 1, cytoplasmic reviewed - Txnrd1 IC50 '=' 180000 nM
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 Potency - 12197 nM
Q03181 BXGT012701 Peroxisome proliferator-activated receptor delta reviewed Nuclear receptor PPARD Potency - 398 nM
P10275 BXGT007552 Androgen receptor reviewed Nuclear receptor AR Potency - 70794 nM
P03372 BXGT006059 Estrogen receptor reviewed Nuclear receptor ESR1 Potency - 3981 nM
P10696 BXGT007603 Alkaline phosphatase, germ cell type reviewed Enzyme ALPG IC50 '>' 100000 nM
P22303 BXGT008751 Acetylcholinesterase reviewed Enzyme ACHE IC50 '=' 18 ug.mL-1
P34913 BXGT009770 Bifunctional epoxide hydrolase 2 reviewed Enzyme EPHX2 Ki '=' 52200 nM
P80457 BXGT011911 Xanthine dehydrogenase/oxidase reviewed - XDH Inhibition '=' 22 %
Q13526 BXGT013369 Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 reviewed - PIN1 Potency - 17782 nM
P37136 BXGT009967 Acetylcholinesterase reviewed - Ache Inhibition '=' 53 %
P34913 BXGT009770 Bifunctional epoxide hydrolase 2 reviewed Enzyme EPHX2 IC50 '=' 26800 nM
P34913 BXGT009770 Bifunctional epoxide hydrolase 2 reviewed Enzyme EPHX2 Inhibition - - -
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00111 Cornmint Mentha arvensis Herbs and Spices
BXGF00459 Wax gourd Benincasa hispida Gourds
BXGF00824 Green vegetables Vegetables
BXGF00892 Leptocereus quadricostatus Leptocereus quadricostatus Others
BXGF00896 Magnolia figo Magnolia figo Human Edible Plant
BXGF00919 Chaiturus marrubiastrum Chaiturus marrubiastrum Others
BXGF01091 Rubus alceifolius Rubus alceifolius Human Edible Plant
BXGF01126 Polygonum cuspidatum Polygonum cuspidatum Medicinal Plant
BXGF01185 Aloe vera Aloe vera Medicinal Plant
BXGF01186 Aloe vera l. var. chinensis (haw.) berger Aloe vera l. var. chinensis (haw.) berger Medicinal Plant
BXGF01187 Onobrychis arenaria Onobrychis arenaria Others
BXGF01307 Hemerocallis radix Hemerocallis radix Others
BXGF01311 Aizopsis selskiana Aizopsis selskiana Others
BXGF01356 Senna occidentalis Senna occidentalis Medicinal Plant
BXGF01473 Siphonostegia chinensis Siphonostegia chinensis Medicinal Plant
BXGF01474 Rheum australe Rheum australe Medicinal Plant
BXGF01529 Rhamnus davurica Rhamnus davurica Medicinal Plant
BXGF01541 Rumex patientia Rumex patientia Medicinal Plant
BXGF01570 Pinalia stricta Pinalia stricta Others
BXGF01623 Amphorogyne spicata Amphorogyne spicata Others
BXGF01695 Tanacetum coccineum Tanacetum coccineum Medicinal Plant
BXGF01716 Mentha canadensis Mentha canadensis Medicinal Plant
BXGF01799 Mandragora autumnalis Mandragora autumnalis Medicinal Plant
BXGF01900 Aloe ferox Aloe ferox Medicinal Plant
BXGF01931 Dalbergia lanceolaria subsp. paniculata Dalbergia lanceolaria subsp. paniculata Medicinal Plant
BXGF02037 Carduus tenuiflorus Carduus tenuiflorus Others
BXGF02203 Verbascum thapsiforme Verbascum thapsiforme Medicinal Plant
BXGF02289 Rhododendron dahuricum Rhododendron dahuricum Others
BXGF02387 Salvia greggii Salvia greggii Medicinal Plant
BXGF02503 Balanophora laxiflora Balanophora laxiflora Others
BXGF02548 Hemerocallis fulva Hemerocallis fulva Medicinal Plant
BXGF02566 Fridericia triplinervia Fridericia triplinervia Others
BXGF02576 Anaphalis lactea Anaphalis lactea Others
BXGF02632 Metrodorea nigra Metrodorea nigra Others
BXGF02724 Tectona grandis Tectona grandis Medicinal Plant
BXGF02814 Senecio praecox Senecio praecox Others
BXGF02817 Garcinia polyantha Garcinia polyantha Medicinal Plant
BXGF02853 Anchusa azurea Anchusa azurea Medicinal Plant
BXGF02880 Nepeta granatensis Nepeta granatensis Others
BXGF02900 Gleichenia quadripartita Gleichenia quadripartita Others
BXGF02932 Dipsacus azureus Dipsacus azureus Others
BXGF02958 Jacquemontia paniculata Jacquemontia paniculata Others
BXGF02993 Caulerpa peltata Caulerpa peltata Human Edible Plant
BXGF03028 Lespedeza tomentosa Lespedeza tomentosa Medicinal Plant
BXGF03042 Rosa pomifera Rosa pomifera Human Edible Plant
BXGF03064 Degenia velebitica Degenia velebitica Others
BXGF03077 Albizia myriophylla Albizia myriophylla Medicinal Plant
BXGF03088 Erythrophleum ivorense Erythrophleum ivorense Medicinal Plant
BXGF03114 Delphinium virgatum Delphinium virgatum Others
BXGF03135 Grangea maderaspatana Grangea maderaspatana Medicinal Plant
BXGF03158 Rheum officinale Rheum officinale Medicinal Plant
BXGF03167 Tagetes filifolia Tagetes filifolia Medicinal Plant
BXGF03217 Delphinium nuttallianum Delphinium nuttallianum Others
BXGF03251 Lupinus corymbosus Lupinus corymbosus Others
BXGF03298 Senecio behnii Senecio behnii Others
BXGF03317 Dillenia indica Dillenia indica Medicinal Plant
BXGF03436 Photinia serratifolia Photinia serratifolia Medicinal Plant
BXGF03512 Helichrysum chionosphaerum Helichrysum chionosphaerum Medicinal Plant
BXGF03556 Actinidia chinensis planch Actinidia chinensis planch Others
BXGF03855 Rumex dentatus Rumex dentatus Medicinal Plant
BXGF03988 Rheum coreanum Rheum coreanum Others
BXGF04062 Spatholobus suberectus Spatholobus suberectus Medicinal Plant
BXGF04229 Petunia integrifolia subsp. inflata Petunia integrifolia subsp. inflata Others
BXGF04263 Glycine soja Glycine soja Medicinal Plant
BXGF04301 Dorstenia dinklagei Dorstenia dinklagei Others
BXGF04328 Croton zehntneri Croton zehntneri Others
BXGF04340 Quercus rubra Quercus rubra Medicinal Plant
BXGF04351 Baccharis potosina Baccharis potosina Others
BXGF04395 Maclura tinctoria Maclura tinctoria Medicinal Plant
BXGF04438 Stevia berlandieri Stevia berlandieri Others
BXGF04499 Ravenia spectabilis Ravenia spectabilis Others
BXGF04539 Rheum palmatum Rheum palmatum Medicinal Plant
BXGF04605 Senna alexandrina Senna alexandrina Medicinal Plant
BXGF04631 Aloe spicata Aloe spicata Medicinal Plant
BXGF04691 Oroxylum indicum Oroxylum indicum Medicinal Plant
BXGF04772 Sapium haematospermum Sapium haematospermum Medicinal Plant
BXGF04862 Oplopanax elatus Oplopanax elatus Medicinal Plant
BXGF04881 Fallopia multiflora Fallopia multiflora Medicinal Plant
BXGF04905 Aloe Aloe Medicinal Plant
BXGF04914 Cassia acutifolia Cassia acutifolia Medicinal Plant
BXGF04916 Cassia mimosoides Cassia mimosoides Medicinal Plant
BXGF04917 Cassia obtusifolia Cassia obtusifolia Medicinal Plant
BXGF04926 Aloe africana Aloe africana Medicinal Plant
BXGF04936 Cassia occidentalis Cassia occidentalis Medicinal Plant
BXGF04968 Cassia angustifolia Cassia angustifolia Medicinal Plant
BXGF04990 Cassia tora Cassia tora Medicinal Plant
BXGF05022 rumex plants rumex plants Others
BXGF05058 kniphofia ensifolia kniphofia ensifolia Others
BXGF05192 Frangula purshiana Frangula purshiana Medicinal Plant
BXGF05224 Cranfillia fluviatilis Cranfillia fluviatilis Medicinal Plant
BXGF05551 Etlingera elatior Etlingera elatior Medicinal Plant
BXGF05877 Rheum tanguticum Rheum tanguticum Medicinal Plant
BXGF05886 Senna tora Senna tora Medicinal Plant
BXGF06095 Rheum undulatum Rheum undulatum Medicinal Plant
BXGF06114 Senna obtusifolia Senna obtusifolia 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