acompound

Showing entry for Sophoricoside

General Compound Information
BXGC Id	BXGC0020083
Compound Name	Sophoricoside
Structure
Formula	C21H20O10
InchiKey	ISQRJFLLIDGZEP-CMWLGVBASA-N
SMILES	OC[C@H]1O[C@@H](Oc2ccc(cc2)c2coc3c(c2=O)c(O)cc(c3)O)[C@@H]([C@H]([C@@H]1O)O)O
Inchi	InChI=1S/C21H20O10/c22-7-15-18(26)19(27)20(28)21(31-15)30-11-3-1-9(2-4-11)12-8-29-14-6-10(23)5-13(24)16(14)17(12)25/h1-6,8,15,18-24,26-28H,7H2/t15-,18-,19+,20-,21-/m1/s1
IUPAC	5,7-dihydroxy-3-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one
Molecular Weight	432.11
Pubchem Id	5321398
Chembl Id	CHEMBL486626

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

50242276

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	BXGT006206	Interleukin-5	reviewed		Il5	-	10600	-	-
reviewed	BXGT006206	Interleukin-5	reviewed		Il5	-	1400	-	-

CHEMBL

CHEMBL486626

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
B2RXH2	BXGT002006	Lysine-specific demethylase 4E	reviewed	-	KDM4E	Potency	'='	35481	nM
B4URF0	BXGT002146	Neuraminidase	unreviewed	-	NA	IC50	'>'	100000	nM
P04401	BXGT006206	Interleukin-5	reviewed	-	Il5	Inhibition	'='	79	%
P04401	BXGT006206	Interleukin-5	reviewed	-	Il5	IC50	'='	1400	nM
P04401	BXGT006206	Interleukin-5	reviewed	-	Il5	Inhibition	'='	92	%
P80457	BXGT011911	Xanthine dehydrogenase/oxidase	reviewed	-	XDH	Inhibition	'='	15	%
P04401	BXGT006206	Interleukin-5	reviewed	-	Il5	IC50	'='	10600	nM
P00352	BXGT005510	Retinal dehydrogenase 1	reviewed	Enzyme	ALDH1A1	Potency	'='	44668	nM
P27695	BXGT009199	DNA-(apurinic or apyrimidinic site) lyase	reviewed	-	APEX1	Potency	-	44668	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00380	White mustard	Sinapis alba	Herbs and Spices
BXGF00861	Abies pinsapo var. marocana	Abies pinsapo var. marocana	Others
BXGF01068	Inulanthera calva	Inulanthera calva	Others
BXGF01318	Nicotiana raimondii	Nicotiana raimondii	Others
BXGF01632	Euphrasia genargentea	Euphrasia genargentea	Others
BXGF01892	Xanthorhiza simplicissima	Xanthorhiza simplicissima	Medicinal Plant
BXGF02139	Scolopia chinensis	Scolopia chinensis	Others
BXGF03152	Sophora japonica	Sophora japonica	Medicinal Plant
BXGF03231	Dactylorhiza viridis	Dactylorhiza viridis	Others
BXGF03271	Pterolobium hexapetalum	Pterolobium hexapetalum	Medicinal Plant
BXGF03813	Diplopterygium glaucum	Diplopterygium glaucum	Others
BXGF04284	Heliotropium hirsutissimum	Heliotropium hirsutissimum	Others
BXGF04296	Maytenus chuchuhuasha	Maytenus chuchuhuasha	Others
BXGF04458	Oxytropis falcata	Oxytropis falcata	Others
BXGF04842	Angelica acutiloba	Angelica acutiloba	Medicinal Plant
BXGF05009	Solanum lanceolatum	Solanum lanceolatum	Medicinal Plant
BXGF05067	Bryonia alba	Bryonia alba	Medicinal Plant
BXGF05141	Viburnum erubescens	Viburnum erubescens	Medicinal Plant
BXGF05212	Trollius europaeus	Trollius europaeus	Medicinal Plant
BXGF05293	Remirea maritima	Remirea maritima	Others
BXGF05364	Arnica mollis	Arnica mollis	Others
BXGF05498	Croton gratissimus	Croton gratissimus	Medicinal Plant
BXGF05559	Wikstroemia viridiflora	Wikstroemia viridiflora	Medicinal Plant
BXGF05584	Brassica carinata	Brassica carinata	Medicinal Plant
BXGF05725	Ranunculus asiaticus	Ranunculus asiaticus	Others
BXGF05736	Eurycoma harmandiana	Eurycoma harmandiana	Medicinal Plant
BXGF05840	Eucalyptus resinifera	Eucalyptus resinifera	Medicinal Plant
BXGF05990	Carpha glomerata	Carpha glomerata	Others
BXGF06093	Cyanostegia angustifolia	Cyanostegia angustifolia	Others
BXGF06149	Orthosiphon spicatus	Orthosiphon spicatus	Medicinal Plant
BXGF06254	Lysimachia fordiana	Lysimachia fordiana	Others
BXGF06278	Ampelocera edentula	Ampelocera edentula	Others
BXGF06294	Arum maximum	Arum maximum	Others
BXGF06304	Ixeris debilis	Ixeris debilis	Others
BXGF06329	Abies excelsa	Abies excelsa	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}