Showing entry for Maltol


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0001995
Compound NameMaltol
Structure
FormulaC6H6O3
InchiKeyXPCTZQVDEJYUGT-UHFFFAOYSA-N
SMILESCC1=C(O)C(=O)C=CO1
InchiInChI=1S/C6H6O3/c1-4-6(8)5(7)2-3-9-4/h2-3,8H,1H3
IUPAC3-hydroxy-2-methyl-4H-pyran-4-one
Molecular Weight126.11
Pubchem Id8369
Chembl IdCHEMBL31422
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 50227434
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 BXGT012782 Lactoylglutathione lyase reviewed GLO1 4.47E+12 - - -
CHEMBL CHEMBL31422
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
P22894 BXGT008815 Neutrophil collagenase reviewed Enzyme MMP8 Inhibition '=' 19 %
Q9Y6L6 BXGT022334 Solute carrier organic anion transporter family member 1B1 reviewed Transporter SLCO1B1 Inhibition '=' 79 %
O42713 BXGT004563 Polyphenol oxidase 2 reviewed - PPO2 Inhibition '=' -6 %
P03956 BXGT006120 Interstitial collagenase reviewed Enzyme MMP1 Inhibition '=' 41 %
P08253 BXGT006757 72 kDa type IV collagenase reviewed Enzyme MMP2 Inhibition '=' 38 %
B2RXH2 BXGT002006 Lysine-specific demethylase 4E reviewed - KDM4E Potency '=' 35481 nM
P02545 BXGT005889 Prelamin-A/C reviewed - LMNA Potency '=' 7943 nM
O75164 BXGT005104 Lysine-specific demethylase 4A reviewed - KDM4A Potency - 25118 nM
Q9F4F7 BXGT020344 4'-phosphopantetheinyl transferase ffp reviewed - ffp Potency '=' 11220 nM
B2RXH2 BXGT002006 Lysine-specific demethylase 4E reviewed - KDM4E Potency '=' 15848 nM
P29477 BXGT009355 Nitric oxide synthase, inducible reviewed - Nos2 Inhibition '=' 6 %
Q03431 BXGT012714 Parathyroid hormone/parathyroid hormone-related peptide receptor reviewed G-protein coupled receptor PTH1R Potency - 7079 nM
P14780 BXGT008053 Matrix metalloproteinase-9 reviewed Enzyme MMP9 Inhibition '=' 32 %
P08254 BXGT006758 Stromelysin-1 reviewed Enzyme MMP3 Inhibition '=' 34 %
P09917 BXGT006941 Arachidonate 5-lipoxygenase reviewed Enzyme ALOX5 Inhibition '=' -319 %
Q04760 BXGT012782 Lactoylglutathione lyase reviewed - GLO1 Ki '=' 4 nM
Q9UIF8 BXGT021718 Bromodomain adjacent to zinc finger domain protein 2B reviewed - BAZ2B Potency - 79432 nM
Q96KQ7 BXGT019687 Histone-lysine N-methyltransferase EHMT2 reviewed Epigenetic regulator EHMT2 Potency - 1778 nM
P15917 BXGT008169 Lethal factor reviewed - lef Inhibition '=' 19 %
Q9NPD5 BXGT021151 Solute carrier organic anion transporter family member 1B3 reviewed Transporter SLCO1B3 Inhibition '=' 74 %
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00040 Pepper (C. annuum) Capsicum annuum Vegetables
BXGF00063 Saffron Crocus sativus Herbs and Spices
BXGF00162 Red raspberry Rubus idaeus Fruits
BXGF00198 Adzuki bean Vigna angularis Pulses
BXGF00201 Climbing bean Vigna umbellata Pulses
BXGF00812 Cocoa and cocoa products Cocoa and cocoa products
BXGF00813 Coffee and coffee products Coffee and coffee products
BXGF00815 Milk and milk products Milk and milk products
BXGF00819 Pulses Pulses
BXGF00821 Nuts Nuts
BXGF00829 Green bell pepper Capsicum annuum Vegetables
BXGF00830 Yellow bell pepper Capsicum annuum Vegetables
BXGF00831 Orange bell pepper Capsicum annuum Vegetables
BXGF00832 Red bell pepper Capsicum annuum Vegetables
BXGF01140 Angelica gigas Angelica gigas Medicinal Plant
BXGF02049 Angelica sinensis Angelica sinensis Medicinal Plant
BXGF02642 Vigna umbeuata Vigna umbeuata Others
BXGF03130 Panax quinquefolius Panax quinquefolius Medicinal Plant
BXGF03348 Panax notoginseng Panax notoginseng Medicinal Plant
BXGF03910 Polyalthia nemoralis Polyalthia nemoralis Medicinal Plant
BXGF04348 Sagittaria sagittifolia Sagittaria sagittifolia Medicinal Plant
BXGF04820 Panax ginseng Panax ginseng 0
BXGF04842 Angelica acutiloba Angelica acutiloba Medicinal Plant
BXGF04933 Rubia wallichiana Rubia wallichiana Medicinal Plant
BXGF05396 Daphne oleoides Daphne oleoides Medicinal Plant
BXGF05433 Liriope muscari Liriope muscari Medicinal Plant
BXGF05810 Pterocarpus indicus Pterocarpus indicus Medicinal Plant
BXGF06185 Ophiopogon japonicus Ophiopogon japonicus 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