acompound

General Compound Information
BXGC Id	BXGC0026346
Compound Name	Ombuine
Structure
Formula	C17H14O7
InchiKey	BWORNNDZQGOKBY-UHFFFAOYSA-N
SMILES	COc1cc(O)c2c(c1)oc(c(c2=O)O)c1ccc(c(c1)O)OC
Inchi	InChI=1S/C17H14O7/c1-22-9-6-11(19)14-13(7-9)24-17(16(21)15(14)20)8-3-4-12(23-2)10(18)5-8/h3-7,18-19,21H,1-2H3
IUPAC	3,5-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-methoxychromen-4-one
Molecular Weight	330.07
Pubchem Id	5320287
Chembl Id	CHEMBL75589

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

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	BXGT013634	Mitogen-activated protein kinase 14	reviewed	Kinase	MAPK14	-	3980	-	-
reviewed	BXGT011014	Mitogen-activated protein kinase 10	reviewed	Kinase	MAPK10	-	55400	-	-
reviewed	BXGT010602	Xanthine dehydrogenase/oxidase	reviewed	Enzyme	XDH	-	7700	-	-

CHEMBL

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
Q86831	BXGT017584	Polyprotein II	unreviewed	-		Inhibition	'='	68	%
Q28731	BXGT013954	Thrombin	unreviewed	-	thrombin	TT	'='	14	s
P47989	BXGT010602	Xanthine dehydrogenase/oxidase	reviewed	Enzyme	XDH	IC50	'='	7700	nM
Q28731	BXGT013954	Thrombin	unreviewed	-	thrombin	PT	'='	7	s
Q28731	BXGT013954	Thrombin	unreviewed	-	thrombin	APTT	'='	46	s
Q28731	BXGT013954	Thrombin	unreviewed	-	thrombin	Activity	'='	5	g/L
P27487	BXGT009187	Dipeptidyl peptidase 4	reviewed	Enzyme	DPP4	IC50	'='	41690	nM
Q16236	BXGT013624	Nuclear factor erythroid 2-related factor 2	reviewed	Enzyme	NFE2L2	Activity	-	-	-

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF01245	Amomum villosum	Amomum villosum	Medicinal Plant
BXGF01279	Coleostephus myconis	Coleostephus myconis	Medicinal Plant
BXGF01505	Gynostemma pentaphyllum	Gynostemma pentaphyllum	Medicinal Plant
BXGF01812	Physalis alkekengi	Physalis alkekengi	Medicinal Plant
BXGF01902	Amomum longiligulare	Amomum longiligulare	Medicinal Plant
BXGF02238	Amomum xanthioides	Amomum xanthioides	Medicinal Plant
BXGF02276	Synotis alata	Synotis alata	Others
BXGF02359	Eucommia ulmoides	Eucommia ulmoides	Medicinal Plant
BXGF03443	Morinda morindoides	Morinda morindoides	Human Edible Plant
BXGF03514	Pteris bella	Pteris bella	Medicinal Plant
BXGF03626	Trichilia heudelotii	Trichilia heudelotii	Others
BXGF03644	Andromeda polifolia	Andromeda polifolia	Medicinal Plant
BXGF03753	Scapania bolanderi	Scapania bolanderi	Others
BXGF03776	Argyrochosma pilifera	Argyrochosma pilifera	Others
BXGF03836	Gymnopetalum integrifolium	Gymnopetalum integrifolium	Medicinal Plant
BXGF03852	Genista lydia	Genista lydia	Others
BXGF03959	Vincetoxicum forrestii	Vincetoxicum forrestii	Others
BXGF04046	Biancaea sappan	Biancaea sappan	Medicinal Plant
BXGF04889	Pogostemon cablin	Pogostemon cablin	Medicinal Plant
BXGF04923	Caesalpinia sappan	Caesalpinia sappan	Medicinal Plant
BXGF05137	Acalypha australis	Acalypha australis	Medicinal Plant
BXGF06171	Dahlia pinnata	Dahlia pinnata	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}