acompound

Showing entry for 3'-(gamma,gamma-Dimethylallyl)genistein

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0009182
Compound Name	3'-(gamma,gamma-Dimethylallyl)genistein
Structure
Formula	C20H18O5
InchiKey	SWDSVBNAMCDHTF-UHFFFAOYSA-N
SMILES	CC(C)=CCC1=C(O)C=CC(=C1)C1=COC2=CC(O)=CC(O)=C2C1=O
Inchi	InChI=1S/C20H18O5/c1-11(2)3-4-13-7-12(5-6-16(13)22)15-10-25-18-9-14(21)8-17(23)19(18)20(15)24/h3,5-10,21-23H,4H2,1-2H3
IUPAC	5,7-dihydroxy-3-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]-4H-chromen-4-one
Molecular Weight	338.35
Pubchem Id	5494866
Chembl Id	CHEMBL464460

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

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
Q92731	BXGT019366	Estrogen receptor beta	reviewed	Nuclear receptor	ESR2	RBA	'='	3	%
B4URF0	BXGT002146	Neuraminidase	unreviewed	-	NA	Ki	-	-	-
B4URF0	BXGT002146	Neuraminidase	unreviewed	-	NA	IC50	'>'	50	ug.mL-1
P03372	BXGT006059	Estrogen receptor	reviewed	Nuclear receptor	ESR1	RBA	'='	1	%
Q96EB6	BXGT019646	NAD-dependent protein deacetylase sirtuin-1	reviewed	Epigenetic regulator	SIRT1	Activity	-	-	-

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00037	Pigeon pea	Cajanus cajan	Pulses
BXGF00819	Pulses		Pulses
BXGF01725	Ficus mucuso	Ficus mucuso	Human Edible Plant
BXGF04734	Cullen corylifolium	Cullen corylifolium	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}