Showing entry for Fraxetin


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0053235
Compound NameFraxetin
Structure
FormulaC10H8O5
InchiKeyHAVWRBANWNTOJX-UHFFFAOYSA-N
SMILESCOc1cc2ccc(=O)oc2c(c1O)O
InchiInChI=1S/C10H8O5/c1-14-6-4-5-2-3-7(11)15-10(5)9(13)8(6)12/h2-4,12-13H,1H3
IUPAC7,8-dihydroxy-6-methoxychromen-2-one
Molecular Weight208.04
Pubchem Id5273569
Chembl IdCHEMBL54909
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 50206215
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 BXGT008837 Prostaglandin G/H synthase 1 reviewed Enzyme PTGS1 - 524000 - -
reviewed BXGT005690 Carbonic anhydrase 2 reviewed CA2 94300 - - -
reviewed BXGT018499 Carbonic anhydrase 13 reviewed CA13 9730 - - -
reviewed BXGT004601 Carbonic anhydrase 12 reviewed CA12 7700 - - -
reviewed BXGT005689 Carbonic anhydrase 1 reviewed CA1 4860 - - -
reviewed BXGT010364 Carbonic anhydrase 7 reviewed CA7 4320 - - -
reviewed BXGT013670 Carbonic anhydrase 9 reviewed CA9 610 - - -
CHEMBL CHEMBL54909
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
P28482 BXGT009263 Mitogen-activated protein kinase 1 reviewed Kinase MAPK1 Potency '=' 31622 nM
Q9F4F7 BXGT020344 4'-phosphopantetheinyl transferase ffp reviewed - ffp Potency '=' 39810 nM
P29466 BXGT009349 Caspase-1 reviewed Enzyme CASP1 Potency '=' 15848 nM
P15428 BXGT008121 15-hydroxyprostaglandin dehydrogenase [NAD(+)] reviewed - HPGD Potency '=' 25118 nM
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 14125 nM
O75164 BXGT005104 Lysine-specific demethylase 4A reviewed - KDM4A Potency - 6309 nM
B2RXH2 BXGT002006 Lysine-specific demethylase 4E reviewed - KDM4E Potency '=' 7079 nM
Q99700 BXGT019949 Ataxin-2 reviewed Nucleic acid binding ATXN2 Potency - 25118 nM
P23219 BXGT008837 Prostaglandin G/H synthase 1 reviewed Enzyme PTGS1 IC50 '=' 524000 nM
P16050 BXGT008184 Arachidonate 15-lipoxygenase reviewed Enzyme ALOX15 Potency '=' 12589 nM
P11712 BXGT007738 Cytochrome P450 2C9 reviewed - CYP2C9 Potency '=' 25118 nM
P15917 BXGT008169 Lethal factor reviewed - lef Potency '=' 31622 nM
O89049 BXGT005293 Thioredoxin reductase 1, cytoplasmic reviewed - Txnrd1 Potency - 89125 nM
O97447 BXGT005436 Putative fructose-1,6-bisphosphate aldolase unreviewed - ald Potency '=' 19905 nM
P33261 BXGT009707 Cytochrome P450 2C19 reviewed - CYP2C19 Potency '=' 39810 nM
P97697 BXGT012214 Inositol monophosphatase 1 reviewed - Impa1 Potency '=' 25118 nM
O43570 BXGT004601 Carbonic anhydrase 12 reviewed - CA12 Ki '=' 7700 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 25929 nM
P55210 BXGT011110 Caspase-7 reviewed Enzyme CASP7 Potency '=' 19952 nM
Q9UNA4 BXGT021785 DNA polymerase iota reviewed - POLI Potency - 50118 nM
P97697 BXGT012214 Inositol monophosphatase 1 reviewed - Impa1 Potency '=' 12589 nM
P00352 BXGT005510 Retinal dehydrogenase 1 reviewed Enzyme ALDH1A1 Potency '=' 31622 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency '=' 14125 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 20596 nM
P97697 BXGT012214 Inositol monophosphatase 1 reviewed - Impa1 Potency '=' 11220 nM
P29466 BXGT009349 Caspase-1 reviewed Enzyme CASP1 Potency '=' 31622 nM
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 19952 nM
P39748 BXGT010134 Flap endonuclease 1 reviewed Enzyme FEN1 Potency - 8912 nM
P43220 BXGT010367 Glucagon-like peptide 1 receptor reviewed G-protein coupled receptor GLP1R Potency - 19952 nM
Q03164 BXGT012700 Histone-lysine N-methyltransferase 2A reviewed - KMT2A Potency '=' 39810 nM
O00255 BXGT003903 Menin reviewed - MEN1 Potency '=' 39810 nM
Q99714 BXGT019954 3-hydroxyacyl-CoA dehydrogenase type-2 reviewed Enzyme HSD17B10 Potency '=' 794 nM
Q9Y6L6 BXGT022334 Solute carrier organic anion transporter family member 1B1 reviewed Transporter SLCO1B1 Inhibition '=' 68 %
Q99714 BXGT019954 3-hydroxyacyl-CoA dehydrogenase type-2 reviewed Enzyme HSD17B10 Potency '=' 1584 nM
Q9UBT6 BXGT021664 DNA polymerase kappa reviewed - POLK Potency - 50118 nM
O97447 BXGT005436 Putative fructose-1,6-bisphosphate aldolase unreviewed - ald Potency '=' 25059 nM
P09917 BXGT006941 Arachidonate 5-lipoxygenase reviewed Enzyme ALOX5 Activity - - -
P00690 BXGT005612 Pancreatic alpha-amylase reviewed - AMY2 Inhibition - - -
O94925 BXGT005342 Glutaminase kidney isoform, mitochondrial reviewed Enzyme GLS Potency - 12589 nM
Q9UBT6 BXGT021664 DNA polymerase kappa reviewed - POLK Potency - 10000 nM
P00918 BXGT005690 Carbonic anhydrase 2 reviewed - CA2 Ki '=' 94300 nM
Q16790 BXGT013670 Carbonic anhydrase 9 reviewed - CA9 Ki '=' 610 nM
P15428 BXGT008121 15-hydroxyprostaglandin dehydrogenase [NAD(+)] reviewed - HPGD Potency '=' 15848 nM
O95149 BXGT005350 Snurportin-1 reviewed - SNUPN Potency - 44668 nM
Q14974 BXGT013516 Importin subunit beta-1 reviewed Transporter KPNB1 Potency - 44668 nM
Q9UBT6 BXGT021664 DNA polymerase kappa reviewed - POLK Potency - 7943 nM
P00915 BXGT005689 Carbonic anhydrase 1 reviewed - CA1 Ki '=' 4860 nM
P43166 BXGT010364 Carbonic anhydrase 7 reviewed - CA7 Ki '=' 4320 nM
P28482 BXGT009263 Mitogen-activated protein kinase 1 reviewed Kinase MAPK1 Potency '=' 15848 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
Q16637 BXGT013646 Survival motor neuron protein reviewed Epigenetic regulator SMN1 Potency '=' 14125 nM
Q99714 BXGT019954 3-hydroxyacyl-CoA dehydrogenase type-2 reviewed Enzyme HSD17B10 Potency '=' 7943 nM
Q8N1Q1 BXGT018499 Carbonic anhydrase 13 reviewed - CA13 Ki '=' 9730 nM
P55210 BXGT011110 Caspase-7 reviewed Enzyme CASP7 Potency '=' 15848 nM
B2RXH2 BXGT002006 Lysine-specific demethylase 4E reviewed - KDM4E Potency '=' 14125 nM
O75496 BXGT005132 Geminin reviewed - GMNN Potency - 651 nM
P27695 BXGT009199 DNA-(apurinic or apyrimidinic site) lyase reviewed - APEX1 Potency - 2818 nM
Q9NPD5 BXGT021151 Solute carrier organic anion transporter family member 1B3 reviewed Transporter SLCO1B3 Inhibition '=' 106 %
Q57TT1 BXGT015153 Uncharacterized protein unreviewed - Tb927.8.6820 Potency - 35481 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF01262 Latua pubiflora Latua pubiflora Others
BXGF01435 Rudbeckia hirta Rudbeckia hirta Medicinal Plant
BXGF01578 Frullania brittoniae Frullania brittoniae Others
BXGF01727 Fraxinus ornus Fraxinus ornus Medicinal Plant
BXGF01739 Acer maximowiczianum Acer maximowiczianum Others
BXGF01779 Fragaria indica Fragaria indica Medicinal Plant
BXGF01879 Blepharis sindica Blepharis sindica Others
BXGF01897 Sinopodophyllum emodi Sinopodophyllum emodi Others
BXGF01974 Phebalium gracile Phebalium gracile Others
BXGF01987 Fraxinus chinensis Fraxinus chinensis Medicinal Plant
BXGF01992 Saracha viscosa Saracha viscosa Others
BXGF02082 Solanum toxicarum Solanum toxicarum Others
BXGF02372 Aesculus turbinata Aesculus turbinata Medicinal Plant
BXGF03556 Actinidia chinensis planch Actinidia chinensis planch Others
BXGF03587 Aesculus hippocastanum Aesculus hippocastanum Medicinal Plant
BXGF03709 Lobelia st Lobelia st Others
BXGF04131 Rhamnus cathartica Rhamnus cathartica Medicinal Plant
BXGF04523 Pinus densiflora var. densiflora Pinus densiflora var. densiflora Medicinal Plant
BXGF04845 Sarcandra glabra Sarcandra glabra Medicinal Plant
BXGF04956 Rhamnus frangula Rhamnus frangula Medicinal Plant
BXGF04957 Acer nikoense Acer nikoense Medicinal Plant
BXGF05112 Fraxinus stylosa Fraxinus stylosa Medicinal Plant
BXGF05167 Allium victorialis Allium victorialis Medicinal Plant
BXGF05483 Rhododendron tomentosum Rhododendron tomentosum Medicinal Plant
BXGF06110 Remijia pedunculata Remijia pedunculata Others
BXGF06269 Fraxinus szaboana Fraxinus szaboana 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