acompound

Showing entry for 5-Hydroxy-2-(3-Hydroxy-4-Methoxyphenyl)-3,6,7,8-Tetramethoxychromen-4-One

General Compound Information
BXGC Id	BXGC0044329
Compound Name	5-Hydroxy-2-(3-Hydroxy-4-Methoxyphenyl)-3,6,7,8-Tetramethoxychromen-4-One
Structure
Formula	C20H20O9
InchiKey	GVLMRDDSMVCWKB-UHFFFAOYSA-N
SMILES	COc1ccc(cc1O)c1oc2c(OC)c(OC)c(c(c2c(=O)c1OC)O)OC
Inchi	InChI=1S/C20H20O9/c1-24-11-7-6-9(8-10(11)21)15-17(25-2)13(22)12-14(23)18(26-3)20(28-5)19(27-4)16(12)29-15/h6-8,21,23H,1-5H3
IUPAC	5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6,7,8-tetramethoxychromen-4-one
Molecular Weight	404.11
Pubchem Id	369954
Chembl Id	CHEMBL18351

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

CHEMBL18351

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
P02550	BXGT005891	Tubulin alpha-1A chain	reviewed	-	TUBA1A	IC50	'='	0	ug.mL-1
Q9BUF5	BXGT020135	Tubulin beta-6 chain	reviewed	Cellular structure	TUBB6	IC50	'='	830	nM
Q9BVA1	BXGT020142	Tubulin beta-2B chain	reviewed	-	TUBB2B	IC50	'='	830	nM
Q13885	BXGT013400	Tubulin beta-2A chain	reviewed	Cellular structure	TUBB2A	IC50	'='	830	nM
Q6PEY2	BXGT016465	Tubulin alpha-3E chain	reviewed	Cellular structure	TUBA3E	IC50	'='	830	nM
Q9BQE3	BXGT020109	Tubulin alpha-1C chain	reviewed	Cellular structure	TUBA1C	IC50	'='	830	nM
P68363	BXGT011594	Tubulin alpha-1B chain	reviewed	Cellular structure	TUBA1B	IC50	'='	830	nM
P07437	BXGT006624	Tubulin beta chain	reviewed	Cellular structure	TUBB	IC50	'='	830	nM
Q3ZCM7	BXGT014551	Tubulin beta-8 chain	reviewed	-	TUBB8	IC50	'='	830	nM
P04350	BXGT006193	Tubulin beta-4A chain	reviewed	Cellular structure	TUBB4A	IC50	'='	830	nM
Q71U36	BXGT016705	Tubulin alpha-1A chain	reviewed	Cellular structure	TUBA1A	IC50	'='	830	nM
Q13509	BXGT013366	Tubulin beta-3 chain	reviewed	Cellular structure	TUBB3	IC50	'='	830	nM
P68366	BXGT011595	Tubulin alpha-4A chain	reviewed	Cellular structure	TUBA4A	IC50	'='	830	nM
P0DPH7	BXGT007527	Tubulin alpha-3C chain	reviewed	-	TUBA3C	IC50	'='	830	nM
Q9H4B7	BXGT020475	Tubulin beta-1 chain	reviewed	Cellular structure	TUBB1	IC50	'='	830	nM
P68371	BXGT011597	Tubulin beta-4B chain	reviewed	Cellular structure	TUBB4B	IC50	'='	830	nM
Q862F3	BXGT017581	Similar to alpha-tubulin isoform 1	unreviewed	-		Inhibition	'='	89	%
Q862L2	BXGT017582	Similar to alpha-tubulin isoform 1	unreviewed	-		Inhibition	'='	89	%
Q6B856	BXGT016212	Tubulin beta-2B chain	reviewed	-	TUBB2B	Inhibition	'='	89	%
Q9BUF5	BXGT020135	Tubulin beta-6 chain	reviewed	Cellular structure	TUBB6	Kd	'='	128	nM
Q9BVA1	BXGT020142	Tubulin beta-2B chain	reviewed	-	TUBB2B	Kd	'='	128	nM
Q13885	BXGT013400	Tubulin beta-2A chain	reviewed	Cellular structure	TUBB2A	Kd	'='	128	nM
Q6PEY2	BXGT016465	Tubulin alpha-3E chain	reviewed	Cellular structure	TUBA3E	Kd	'='	128	nM
Q9BQE3	BXGT020109	Tubulin alpha-1C chain	reviewed	Cellular structure	TUBA1C	Kd	'='	128	nM
P68363	BXGT011594	Tubulin alpha-1B chain	reviewed	Cellular structure	TUBA1B	Kd	'='	128	nM
P07437	BXGT006624	Tubulin beta chain	reviewed	Cellular structure	TUBB	Kd	'='	128	nM
Q3ZCM7	BXGT014551	Tubulin beta-8 chain	reviewed	-	TUBB8	Kd	'='	128	nM
P04350	BXGT006193	Tubulin beta-4A chain	reviewed	Cellular structure	TUBB4A	Kd	'='	128	nM
Q71U36	BXGT016705	Tubulin alpha-1A chain	reviewed	Cellular structure	TUBA1A	Kd	'='	128	nM
Q13509	BXGT013366	Tubulin beta-3 chain	reviewed	Cellular structure	TUBB3	Kd	'='	128	nM
P68366	BXGT011595	Tubulin alpha-4A chain	reviewed	Cellular structure	TUBA4A	Kd	'='	128	nM
P0DPH7	BXGT007527	Tubulin alpha-3C chain	reviewed	-	TUBA3C	Kd	'='	128	nM
Q9H4B7	BXGT020475	Tubulin beta-1 chain	reviewed	Cellular structure	TUBB1	Kd	'='	128	nM
P68371	BXGT011597	Tubulin beta-4B chain	reviewed	Cellular structure	TUBB4B	Kd	'='	128	nM
Q9BUF5	BXGT020135	Tubulin beta-6 chain	reviewed	Cellular structure	TUBB6	Kd	'='	130	nM
Q9BVA1	BXGT020142	Tubulin beta-2B chain	reviewed	-	TUBB2B	Kd	'='	130	nM
Q13885	BXGT013400	Tubulin beta-2A chain	reviewed	Cellular structure	TUBB2A	Kd	'='	130	nM
Q6PEY2	BXGT016465	Tubulin alpha-3E chain	reviewed	Cellular structure	TUBA3E	Kd	'='	130	nM
Q9BQE3	BXGT020109	Tubulin alpha-1C chain	reviewed	Cellular structure	TUBA1C	Kd	'='	130	nM
P68363	BXGT011594	Tubulin alpha-1B chain	reviewed	Cellular structure	TUBA1B	Kd	'='	130	nM
P07437	BXGT006624	Tubulin beta chain	reviewed	Cellular structure	TUBB	Kd	'='	130	nM
Q3ZCM7	BXGT014551	Tubulin beta-8 chain	reviewed	-	TUBB8	Kd	'='	130	nM
P04350	BXGT006193	Tubulin beta-4A chain	reviewed	Cellular structure	TUBB4A	Kd	'='	130	nM
Q71U36	BXGT016705	Tubulin alpha-1A chain	reviewed	Cellular structure	TUBA1A	Kd	'='	130	nM
Q13509	BXGT013366	Tubulin beta-3 chain	reviewed	Cellular structure	TUBB3	Kd	'='	130	nM
P68366	BXGT011595	Tubulin alpha-4A chain	reviewed	Cellular structure	TUBA4A	Kd	'='	130	nM
P0DPH7	BXGT007527	Tubulin alpha-3C chain	reviewed	-	TUBA3C	Kd	'='	130	nM
Q9H4B7	BXGT020475	Tubulin beta-1 chain	reviewed	Cellular structure	TUBB1	Kd	'='	130	nM
P68371	BXGT011597	Tubulin beta-4B chain	reviewed	Cellular structure	TUBB4B	Kd	'='	130	nM
Q862F3	BXGT017581	Similar to alpha-tubulin isoform 1	unreviewed	-		Inhibition	'='	59	%
Q862L2	BXGT017582	Similar to alpha-tubulin isoform 1	unreviewed	-		Inhibition	'='	59	%
Q6B856	BXGT016212	Tubulin beta-2B chain	reviewed	-	TUBB2B	Inhibition	'='	59	%

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00025	Common beet	Beta vulgaris	Vegetables
BXGF00897	Afrocarpus falcatus	Afrocarpus falcatus	Medicinal Plant
BXGF02669	Canella winterana	Canella winterana	Medicinal Plant
BXGF03003	Flemingia chappar	Flemingia chappar	Medicinal Plant
BXGF03304	Sporobolus cynosuroides	Sporobolus cynosuroides	Others
BXGF03544	Nicotiana debneyi	Nicotiana debneyi	Others
BXGF03669	Clausena lansium	Clausena lansium	Medicinal Plant
BXGF03690	Narcissus obesus	Narcissus obesus	Others
BXGF03823	Thalictrum cultratum	Thalictrum cultratum	Medicinal Plant
BXGF03842	Turricula parryi	Turricula parryi	Others
BXGF03862	Sophora exigua	Sophora exigua	Others
BXGF03881	Acacia pycnantha	Acacia pycnantha	Medicinal Plant
BXGF03952	Ericameria diffusa	Ericameria diffusa	Others
BXGF04032	Ocotea pulchella	Ocotea pulchella	Others
BXGF04040	Uncaria laevigata	Uncaria laevigata	Medicinal Plant
BXGF04093	Lippia mexicana	Lippia mexicana	Human Edible Plant
BXGF04139	Carlina acaulis	Carlina acaulis	Medicinal Plant
BXGF04145	Salvia digitaloides	Salvia digitaloides	Medicinal Plant
BXGF04154	Eumorphia sericea	Eumorphia sericea	Others
BXGF04162	Asterogyne martiana	Asterogyne martiana	Others
BXGF04181	Eupatorium birmanicum	Eupatorium birmanicum	Medicinal Plant
BXGF04206	Cirsium tanakae	Cirsium tanakae	Human Edible Plant
BXGF04246	Chrysosplenium echinus	Chrysosplenium echinus	Others
BXGF04253	Eriostemon thryptomenoides	Eriostemon thryptomenoides	Others
BXGF04282	Beilschmiedia volckii	Beilschmiedia volckii	Others
BXGF04290	Garcinia pseudoguttifera	Garcinia pseudoguttifera	Medicinal Plant
BXGF04305	Heliotropium eichwaldii	Heliotropium eichwaldii	Medicinal Plant
BXGF04311	Berkheya zeyheri	Berkheya zeyheri	Human Edible Plant
BXGF04314	Xanthium pungens	Xanthium pungens	Others
BXGF04320	Ligularia lamarum	Ligularia lamarum	Others
BXGF04322	Baccharis magellanica	Baccharis magellanica	Others
BXGF04339	Thermopsis alpina	Thermopsis alpina	Medicinal Plant
BXGF04352	Aloe vulgaris	Aloe vulgaris	Human Edible Plant
BXGF04762	Gutierrezia microcephala	Gutierrezia microcephala	Others
BXGF06112	Daphne giraldii	Daphne giraldii	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}