acompound

Showing entry for Santin

General Compound Information
BXGC Id	BXGC0026758
Compound Name	Santin
Structure
Formula	C18H16O7
InchiKey	DWZAJFZEYZIHPO-UHFFFAOYSA-N
SMILES	COc1ccc(cc1)c1oc2cc(O)c(c(c2c(=O)c1OC)O)OC
Inchi	InChI=1S/C18H16O7/c1-22-10-6-4-9(5-7-10)16-18(24-3)15(21)13-12(25-16)8-11(19)17(23-2)14(13)20/h4-8,19-20H,1-3H3
IUPAC	5,7-dihydroxy-3,6-dimethoxy-2-(4-methoxyphenyl)chromen-4-one
Molecular Weight	344.09
Pubchem Id	5281695
Chembl Id	CHEMBL161957

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

50240898

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	BXGT010602	Xanthine dehydrogenase/oxidase	reviewed	Enzyme	XDH	-	36500	-	-

CHEMBL

CHEMBL161957

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
O75874	BXGT005157	Isocitrate dehydrogenase [NADP] cytoplasmic	reviewed	-	IDH1	Potency	-	20596	nM
Q99700	BXGT019949	Ataxin-2	reviewed	Nucleic acid binding	ATXN2	Potency	-	11220	nM
Q9BUF5	BXGT020135	Tubulin beta-6 chain	reviewed	Cellular structure	TUBB6	IC50	'='	5700	nM
Q9BVA1	BXGT020142	Tubulin beta-2B chain	reviewed	-	TUBB2B	IC50	'='	5700	nM
Q13885	BXGT013400	Tubulin beta-2A chain	reviewed	Cellular structure	TUBB2A	IC50	'='	5700	nM
Q6PEY2	BXGT016465	Tubulin alpha-3E chain	reviewed	Cellular structure	TUBA3E	IC50	'='	5700	nM
Q9BQE3	BXGT020109	Tubulin alpha-1C chain	reviewed	Cellular structure	TUBA1C	IC50	'='	5700	nM
P68363	BXGT011594	Tubulin alpha-1B chain	reviewed	Cellular structure	TUBA1B	IC50	'='	5700	nM
P07437	BXGT006624	Tubulin beta chain	reviewed	Cellular structure	TUBB	IC50	'='	5700	nM
Q3ZCM7	BXGT014551	Tubulin beta-8 chain	reviewed	-	TUBB8	IC50	'='	5700	nM
P04350	BXGT006193	Tubulin beta-4A chain	reviewed	Cellular structure	TUBB4A	IC50	'='	5700	nM
Q71U36	BXGT016705	Tubulin alpha-1A chain	reviewed	Cellular structure	TUBA1A	IC50	'='	5700	nM
Q13509	BXGT013366	Tubulin beta-3 chain	reviewed	Cellular structure	TUBB3	IC50	'='	5700	nM
P68366	BXGT011595	Tubulin alpha-4A chain	reviewed	Cellular structure	TUBA4A	IC50	'='	5700	nM
P0DPH7	BXGT007527	Tubulin alpha-3C chain	reviewed	-	TUBA3C	IC50	'='	5700	nM
Q9H4B7	BXGT020475	Tubulin beta-1 chain	reviewed	Cellular structure	TUBB1	IC50	'='	5700	nM
P68371	BXGT011597	Tubulin beta-4B chain	reviewed	Cellular structure	TUBB4B	IC50	'='	5700	nM
Q9UIF8	BXGT021718	Bromodomain adjacent to zinc finger domain protein 2B	reviewed	-	BAZ2B	Potency	-	79432	nM
Q9BUF5	BXGT020135	Tubulin beta-6 chain	reviewed	Cellular structure	TUBB6	Inhibition	'='	100	%
Q9BVA1	BXGT020142	Tubulin beta-2B chain	reviewed	-	TUBB2B	Inhibition	'='	100	%
Q13885	BXGT013400	Tubulin beta-2A chain	reviewed	Cellular structure	TUBB2A	Inhibition	'='	100	%
Q6PEY2	BXGT016465	Tubulin alpha-3E chain	reviewed	Cellular structure	TUBA3E	Inhibition	'='	100	%
Q9BQE3	BXGT020109	Tubulin alpha-1C chain	reviewed	Cellular structure	TUBA1C	Inhibition	'='	100	%
P68363	BXGT011594	Tubulin alpha-1B chain	reviewed	Cellular structure	TUBA1B	Inhibition	'='	100	%
P07437	BXGT006624	Tubulin beta chain	reviewed	Cellular structure	TUBB	Inhibition	'='	100	%
Q3ZCM7	BXGT014551	Tubulin beta-8 chain	reviewed	-	TUBB8	Inhibition	'='	100	%
P04350	BXGT006193	Tubulin beta-4A chain	reviewed	Cellular structure	TUBB4A	Inhibition	'='	100	%
Q71U36	BXGT016705	Tubulin alpha-1A chain	reviewed	Cellular structure	TUBA1A	Inhibition	'='	100	%
Q13509	BXGT013366	Tubulin beta-3 chain	reviewed	Cellular structure	TUBB3	Inhibition	'='	100	%
P68366	BXGT011595	Tubulin alpha-4A chain	reviewed	Cellular structure	TUBA4A	Inhibition	'='	100	%
P0DPH7	BXGT007527	Tubulin alpha-3C chain	reviewed	-	TUBA3C	Inhibition	'='	100	%
Q9H4B7	BXGT020475	Tubulin beta-1 chain	reviewed	Cellular structure	TUBB1	Inhibition	'='	100	%
P68371	BXGT011597	Tubulin beta-4B chain	reviewed	Cellular structure	TUBB4B	Inhibition	'='	100	%
Q965D5	BXGT019600	Enoyl-acyl-carrier protein reductase	unreviewed	-	fabI	IC50	-	-	-
P14618	BXGT008027	Pyruvate kinase PKM	reviewed	Kinase	PKM	Potency	'='	25118	nM
P10636	BXGT007596	Microtubule-associated protein tau	reviewed	-	MAPT	Potency	'='	22387	nM
Q9NUW8	BXGT021219	Tyrosyl-DNA phosphodiesterase 1	reviewed	Enzyme	TDP1	Potency	-	12995	nM
P51450	BXGT010847	Nuclear receptor ROR-gamma	reviewed	-	Rorc	Potency	'='	22387	nM
Q9HC16	BXGT020525	DNA dC->dU-editing enzyme APOBEC-3G	reviewed	Enzyme	APOBEC3G	Potency	-	7079	nM
P47989	BXGT010602	Xanthine dehydrogenase/oxidase	reviewed	Enzyme	XDH	IC50	'='	36500	nM
Q194T2	BXGT013743	Non-structural protein 1	unreviewed	-	NS1	Potency	'='	15848	nM
O75496	BXGT005132	Geminin	reviewed	-	GMNN	Potency	-	16360	nM
P80457	BXGT011911	Xanthine dehydrogenase/oxidase	reviewed	-	XDH	Inhibition	-	-	-
P43220	BXGT010367	Glucagon-like peptide 1 receptor	reviewed	G-protein coupled receptor	GLP1R	Potency	-	3981	nM
O75496	BXGT005132	Geminin	reviewed	-	GMNN	Potency	-	5173	nM
P80457	BXGT011911	Xanthine dehydrogenase/oxidase	reviewed	-	XDH	IC50	'='	220	nM
Q4QEW7	BXGT014876	Dihydroorotate dehydrogenase (fumarate)	unreviewed	-	DHODH	IC50	'='	261800	nM
P08659	BXGT006805	Luciferin 4-monooxygenase	reviewed	-		Potency	-	19011	nM
P27695	BXGT009199	DNA-(apurinic or apyrimidinic site) lyase	reviewed	-	APEX1	Potency	-	28	nM
Q9NUW8	BXGT021219	Tyrosyl-DNA phosphodiesterase 1	reviewed	Enzyme	TDP1	Potency	-	10322	nM
Q4QEW7	BXGT014876	Dihydroorotate dehydrogenase (fumarate)	unreviewed	-	DHODH	IC50	'='	251188	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00038	Tea	Camellia sinensis	Teas
BXGF00912	Plectranthus nummularius	Plectranthus nummularius	Medicinal Plant
BXGF00934	Aristolochia maxima	Aristolochia maxima	Medicinal Plant
BXGF01077	Entada polystachya	Entada polystachya	Others
BXGF01163	Entada africana	Entada africana	Medicinal Plant
BXGF01182	Betula mandshurica	Betula mandshurica	Medicinal Plant
BXGF01213	Iberis sempervirens	Iberis sempervirens	Others
BXGF01247	Achillea collina	Achillea collina	Others
BXGF01415	Mikania obtusata	Mikania obtusata	Others
BXGF01522	Orobanche speciosa	Orobanche speciosa	Others
BXGF01557	Jasminum officinale	Jasminum officinale	Medicinal Plant
BXGF01608	Schumanniophyton magnificum	Schumanniophyton magnificum	Others
BXGF01715	Bergenia purpurascens	Bergenia purpurascens	Medicinal Plant
BXGF01755	Fumaria indica	Fumaria indica	Medicinal Plant
BXGF01763	Kadsura interior	Kadsura interior	Medicinal Plant
BXGF01811	Dioscorea gracillima	Dioscorea gracillima	Medicinal Plant
BXGF01917	Vitex limonifolia	Vitex limonifolia	Others
BXGF01946	Asparagus africanus	Asparagus africanus	Medicinal Plant
BXGF01961	Polygala myrtifolia	Polygala myrtifolia	Others
BXGF01980	Eichhornia crassipes	Eichhornia crassipes	Medicinal Plant
BXGF02021	Alnus japonica	Alnus japonica	Medicinal Plant
BXGF02045	Echium rubrum	Echium rubrum	Others
BXGF02090	Ligularia platyglossa	Ligularia platyglossa	Medicinal Plant
BXGF02128	Rhodiola krylovii	Rhodiola krylovii	Others
BXGF02188	Penstemon newberryi	Penstemon newberryi	Others
BXGF02224	Rapanea myricoides	Rapanea myricoides	Others
BXGF02247	Crataegus sinaica	Crataegus sinaica	Human Edible Plant
BXGF02298	Malus asiatica	Malus asiatica	Medicinal Plant
BXGF02310	Craibiodendron henryi	Craibiodendron henryi	Others
BXGF02371	Justicia ciliata	Justicia ciliata	Others
BXGF02396	Artemisia vachanica	Artemisia vachanica	Others
BXGF02411	Lasiocephalus ovatus	Lasiocephalus ovatus	Others
BXGF02427	Montrouziera sphaeroidea	Montrouziera sphaeroidea	Others
BXGF02443	Cotoneaster orbicularis	Cotoneaster orbicularis	Others
BXGF02450	Bischofia trifoliata	Bischofia trifoliata	Others
BXGF02517	Pimpinella saxifraga	Pimpinella saxifraga	Medicinal Plant
BXGF02531	Caragana tibetica	Caragana tibetica	Medicinal Plant
BXGF02538	Macrotyloma axillare	Macrotyloma axillare	Others
BXGF02555	Trigonostemon reidioides	Trigonostemon reidioides	Medicinal Plant
BXGF02581	Euphorbia ferganensis	Euphorbia ferganensis	Others
BXGF02594	Arachniodes dimorphophylla	Arachniodes dimorphophylla	Others
BXGF02608	Oreosolen wattii	Oreosolen wattii	Others
BXGF02675	Salacia elliptica	Salacia elliptica	Human Edible Plant
BXGF02698	Crataegus tanacetifolia	Crataegus tanacetifolia	Medicinal Plant
BXGF02742	Discaria crenata	Discaria crenata	Others
BXGF02761	Croton cascarilloides	Croton cascarilloides	Medicinal Plant
BXGF02833	Polygonatum zanlanscianense	Polygonatum zanlanscianense	Medicinal Plant
BXGF02931	Solanum chilense	Solanum chilense	Others
BXGF03472	Tropaeolum speciosum	Tropaeolum speciosum	Others
BXGF04120	Solanum bahamense	Solanum bahamense	Others
BXGF04247	Tinospora smilacina	Tinospora smilacina	Medicinal Plant
BXGF04408	Sarcomelicope argyrophylla	Sarcomelicope argyrophylla	Others
BXGF04698	Isodon rubescens	Isodon rubescens	Others
BXGF05020	gardenia urvillei	gardenia urvillei	Others
BXGF05239	Dicranopteris linearis	Dicranopteris linearis	Medicinal Plant
BXGF05634	Roemeria carica	Roemeria carica	Others
BXGF05751	Vatica diospyroides	Vatica diospyroides	Others
BXGF06016	Pteris setuloso-costulata	Pteris setuloso-costulata	Others
BXGF06041	Pithecellobium clypearia	Pithecellobium clypearia	Medicinal Plant
BXGF06140	Tanacetum parthenium	Tanacetum parthenium	Medicinal Plant
BXGF06205	Pseuduvaria indochinensis	Pseuduvaria indochinensis	Others
BXGF06221	Annona rensoniana	Annona rensoniana	Others
BXGF06238	Gardenia jasminoides	Gardenia jasminoides	Medicinal Plant
BXGF06287	Monomeria barbata	Monomeria barbata	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}