acompound

Showing entry for 3',4',7-Trihydroxyflavone

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0005766
Compound Name	3',4',7-Trihydroxyflavone
Structure
Formula	C15H10O5
InchiKey	PVFGJHYLIHMCQD-UHFFFAOYSA-N
SMILES	OC1=CC2=C(C=C1)C(=O)C=C(O2)C1=CC(O)=C(O)C=C1
Inchi	InChI=1S/C15H10O5/c16-9-2-3-10-12(18)7-14(20-15(10)6-9)8-1-4-11(17)13(19)5-8/h1-7,16-17,19H
IUPAC	2-(3,4-dihydroxyphenyl)-7-hydroxy-4H-chromen-4-one
Molecular Weight	270.24
Pubchem Id	5322065
Chembl Id	CHEMBL301624

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

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
Q9H2K2	BXGT020454	Poly [ADP-ribose] polymerase tankyrase-2	reviewed	TNKS2	-	-	-	-	-

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	BXGT004091	Telomerase reverse transcriptase	reviewed	Enzyme	TERT	-	>40000	-	-
reviewed	BXGT008197	Aldo-keto reductase family 1 member B1	reviewed		AKR1B1	-	6520	-	-
reviewed	BXGT006934	Poly [ADP-ribose] polymerase 1	reviewed		PARP1	-	7500	-	-
reviewed	BXGT020454	Poly [ADP-ribose] polymerase tankyrase-2	reviewed		TNKS2	-	870	-	-
reviewed	BXGT005369	Poly [ADP-ribose] polymerase tankyrase-1	reviewed		TNKS	-	630	-	-
reviewed	BXGT006941	Arachidonate 5-lipoxygenase	reviewed	Enzyme	ALOX5	-	2000	-	-

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
P08170	BXGT006736	Seed linoleate 13S-lipoxygenase-1	reviewed	-	LOX1.1	Vmax	'='	0	uM
P08170	BXGT006736	Seed linoleate 13S-lipoxygenase-1	reviewed	-	LOX1.1	Activity	-	-	-
O14746	BXGT004091	Telomerase reverse transcriptase	reviewed	Enzyme	TERT	IC50	'>'	40000	nM
P16116	BXGT008197	Aldo-keto reductase family 1 member B1	reviewed	-	AKR1B1	IC50	'='	6520	nM
O95271	BXGT005369	Poly [ADP-ribose] polymerase tankyrase-1	reviewed	-	TNKS	IC50	'='	630	nM
O95271	BXGT005369	Poly [ADP-ribose] polymerase tankyrase-1	reviewed	-	TNKS	IC50	'='	645	nM
P27169	BXGT009161	Serum paraoxonase/arylesterase 1	reviewed	-	PON1	Ka	'='	1	10'5/M
P27169	BXGT009161	Serum paraoxonase/arylesterase 1	reviewed	-	PON1	KSV	'='	0	10'5/M
P27169	BXGT009161	Serum paraoxonase/arylesterase 1	reviewed	-	PON1	Kq	'='	0	10'12/M/s
P09874	BXGT006934	Poly [ADP-ribose] polymerase 1	reviewed	-	PARP1	IC50	'='	7585	nM
P08170	BXGT006736	Seed linoleate 13S-lipoxygenase-1	reviewed	-	LOX1.1	Vmax	'='	0	uM
P08170	BXGT006736	Seed linoleate 13S-lipoxygenase-1	reviewed	-	LOX1.1	Km	'='	97360	nM
P09917	BXGT006941	Arachidonate 5-lipoxygenase	reviewed	Enzyme	ALOX5	IC50	'='	2000	nM
P09874	BXGT006934	Poly [ADP-ribose] polymerase 1	reviewed	-	PARP1	IC50	'='	7500	nM
Q9H2K2	BXGT020454	Poly [ADP-ribose] polymerase tankyrase-2	reviewed	-	TNKS2	IC50	'='	870	nM
Q9H2K2	BXGT020454	Poly [ADP-ribose] polymerase tankyrase-2	reviewed	-	TNKS2	IC50	'='	870	nM
P08170	BXGT006736	Seed linoleate 13S-lipoxygenase-1	reviewed	-	LOX1.1	Ki	-	-	-
P08170	BXGT006736	Seed linoleate 13S-lipoxygenase-1	reviewed	-	LOX1.1	Km	'='	190500	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00186	Fenugreek	Trigonella foenum-graecum	Herbs and Spices
BXGF00197	Broad bean	Vicia faba	Pulses
BXGF00264	Alfalfa	Medicago sativa	Herbs and Spices
BXGF00857	Mitracarpus scaber	Mitracarpus scaber	Others
BXGF01324	Albizia julibrissin	Albizia julibrissin	Medicinal Plant
BXGF02381	Glycyrrhiza inflata	Glycyrrhiza inflata	Medicinal Plant
BXGF04263	Glycine soja	Glycine soja	Medicinal Plant
BXGF04301	Dorstenia dinklagei	Dorstenia dinklagei	Others
BXGF04312	Sophora viciifolia	Sophora viciifolia	Medicinal Plant
BXGF04328	Croton zehntneri	Croton zehntneri	Others
BXGF04750	Scutellaria baicalensis	Scutellaria baicalensis	Medicinal Plant
BXGF04772	Sapium haematospermum	Sapium haematospermum	Medicinal Plant
BXGF04872	Glycyrrhiza glabra	Glycyrrhiza glabra	Medicinal Plant
BXGF05108	Sophora mollis	Sophora mollis	Medicinal Plant
BXGF05790	Glycyrrhiza uralensis	Glycyrrhiza uralensis	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}