acompound

Showing entry for Miquelianin

General Compound Information
BXGC Id	BXGC0033768
Compound Name	Miquelianin
Structure
Formula	C21H20O12
InchiKey	OVSQVDMCBVZWGM-DHALZPNHSA-N
SMILES	OC[C@H]1O[C@H](Oc2c(oc3c(c2=O)c(O)cc(c3)O)c2ccc(c(c2)O)O)[C@@H]([C@H]([C@@H]1O)O)O
Inchi	InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18-,21-/m1/s1
IUPAC	2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Molecular Weight	464.1
Pubchem Id	12304323
Chembl Id	CHEMBL1098724

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

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

CHEMBL1098724

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
P18825	BXGT008426	Alpha-2C adrenergic receptor	reviewed	G-protein coupled receptor	ADRA2C	Ki	'='	4063	nM
Q9NPH5	BXGT021159	NADPH oxidase 4	reviewed	Enzyme	NOX4	IC50	'='	830	nM
Q9NPH5	BXGT021159	NADPH oxidase 4	reviewed	Enzyme	NOX4	Inhibition	'='	104	%
Q9NPH5	BXGT021159	NADPH oxidase 4	reviewed	Enzyme	NOX4	Inhibition	'='	105	%

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00194	Lingonberry	Vaccinium vitis-idaea	Fruits
BXGF00908	Tropaeolum majus	Tropaeolum majus	Medicinal Plant
BXGF01807	Ficus sarmentosa var. thunbergii	Ficus sarmentosa var. thunbergii	Human Edible Plant
BXGF01908	Rhus chinensis	Rhus chinensis	Medicinal Plant
BXGF02044	Chrysothamnus parryi	Chrysothamnus parryi	Others
BXGF02971	Dryopteris aitoniana	Dryopteris aitoniana	Others
BXGF03030	Erythrina sacleuxii	Erythrina sacleuxii	Others
BXGF03190	Phytolacca thyrsiflora	Phytolacca thyrsiflora	Others
BXGF03285	Corydalis thalictrifolia	Corydalis thalictrifolia	Medicinal Plant
BXGF03364	Astragalus asper	Astragalus asper	Others
BXGF03406	Daphne lancifolia	Daphne lancifolia	Others
BXGF03424	Calliandra eriophylla	Calliandra eriophylla	Others
BXGF03479	Bombax ceiba	Bombax ceiba	Medicinal Plant
BXGF03628	Dioscorea althaeoides	Dioscorea althaeoides	Medicinal Plant
BXGF03692	Gardneria insularis	Gardneria insularis	Others
BXGF03724	Scilla maritima	Scilla maritima	Medicinal Plant
BXGF03746	Osteophloeum platyspermum	Osteophloeum platyspermum	Others
BXGF03798	Glycyrrhiza lepidota	Glycyrrhiza lepidota	Medicinal Plant
BXGF03820	Artemisia tournefortiana	Artemisia tournefortiana	Others
BXGF03977	Magnolia sprengeri	Magnolia sprengeri	Medicinal Plant
BXGF03993	Aulacomnium androgynum	Aulacomnium androgynum	Medicinal Plant
BXGF04012	Valeriana fedtschenkoi	Valeriana fedtschenkoi	Others
BXGF04044	Cosmos pringlei	Cosmos pringlei	Others
BXGF04059	Taraxacum bicorne	Taraxacum bicorne	Others
BXGF04068	Albertisia papuana	Albertisia papuana	Human Edible Plant
BXGF04077	Cordia curassavica	Cordia curassavica	Medicinal Plant
BXGF04087	Erysimum odoratum	Erysimum odoratum	Others
BXGF04092	Heterotheca inuloides	Heterotheca inuloides	Medicinal Plant
BXGF04098	Delphinium andersoni	Delphinium andersoni	Others
BXGF04117	Lafoensia glyptocarpa	Lafoensia glyptocarpa	Others
BXGF04126	Vismia jefensis	Vismia jefensis	Others
BXGF04142	Angelica tarokoensis	Angelica tarokoensis	Others
BXGF04147	Swertia delavayi	Swertia delavayi	Others
BXGF04165	Epimedium davidii	Epimedium davidii	Medicinal Plant
BXGF04168	Globba malaccensis	Globba malaccensis	Medicinal Plant
BXGF04175	Diphasia angolensis	Diphasia angolensis	Others
BXGF04182	Knightia excelsa	Knightia excelsa	Medicinal Plant
BXGF04199	Isodon japonicus	Isodon japonicus	Medicinal Plant
BXGF04207	Solanum acaule	Solanum acaule	Others
BXGF04216	Frullania tamarisci	Frullania tamarisci	Others
BXGF04221	Alangium premnifolium	Alangium premnifolium	Others
BXGF04233	Saussurea carthamoides	Saussurea carthamoides	Others
BXGF04250	Galenia africana	Galenia africana	Medicinal Plant
BXGF04264	Micromeria pineolens	Micromeria pineolens	Others
BXGF04269	Gnidia lamprantha	Gnidia lamprantha	Medicinal Plant
BXGF04276	Ilex amara	Ilex amara	Others
BXGF04295	Leonurus glaucescens	Leonurus glaucescens	Medicinal Plant
BXGF04342	Salacia madagascariensis	Salacia madagascariensis	Human Edible Plant
BXGF04343	Maba buxifolia	Maba buxifolia	Medicinal Plant
BXGF04392	Artemisia carvifolia	Artemisia carvifolia	Others
BXGF04777	Quercus sessiliflora	Quercus sessiliflora	Others
BXGF04847	Ficus cordata subsp. salicifolia	Ficus cordata subsp. salicifolia	Medicinal Plant
BXGF04992	Cephalaria uralensis	Cephalaria uralensis	Others
BXGF05215	Geranium sylvaticum	Geranium sylvaticum	Others
BXGF05216	Lonchocarpus orotinus	Lonchocarpus orotinus	Others
BXGF05263	Hedyosmum arborescens	Hedyosmum arborescens	Others
BXGF05314	Kopsia profunda	Kopsia profunda	Others
BXGF05391	Derris uliginosa	Derris uliginosa	Medicinal Plant
BXGF05441	Haplophyllum ferganicum	Haplophyllum ferganicum	Others
BXGF05478	Callicarpa maingayi	Callicarpa maingayi	Others
BXGF05480	Lepidium draba	Lepidium draba	Medicinal Plant
BXGF05487	Crotalaria aegyptiaca	Crotalaria aegyptiaca	Others
BXGF05578	Aglaia laxiflora	Aglaia laxiflora	Human Edible Plant
BXGF05595	Dahlstedtia araripensis	Dahlstedtia araripensis	Others
BXGF05766	Dicoma capensis	Dicoma capensis	Medicinal Plant
BXGF05872	Digitalis isabelliana	Digitalis isabelliana	Others
BXGF05873	Scopolia hladnikiana	Scopolia hladnikiana	Others
BXGF06087	Sonchus ortunoi	Sonchus ortunoi	Others
BXGF06111	Pteris radiata	Pteris radiata	Others
BXGF06174	Styrax ferrugineus	Styrax ferrugineus	Medicinal Plant
BXGF06255	Psorospermum adamauense	Psorospermum adamauense	Others
BXGF06277	Vincetoxicum hirundinaria	Vincetoxicum hirundinaria	Medicinal Plant
BXGF06323	Euphorbia turczaninowii	Euphorbia turczaninowii	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}