acompound

Showing entry for 4-(4-Methoxyphenyl)-2-butanone

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0005516
Compound Name	4-(4-Methoxyphenyl)-2-butanone
Structure
Formula	C11H14O2
InchiKey	PCBSXBYCASFXTM-UHFFFAOYSA-N
SMILES	COC1=CC=C(CCC(C)=O)C=C1
Inchi	InChI=1S/C11H14O2/c1-9(12)3-4-10-5-7-11(13-2)8-6-10/h5-8H,3-4H2,1-2H3
IUPAC	4-(4-methoxyphenyl)butan-2-one
Molecular Weight	178.23
Pubchem Id	61007
Chembl Id	CHEMBL3184371

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
P54803	BXGT011082	Galactocerebrosidase	reviewed	-	GALC	Potency	-	707	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00082	Fennel	Foeniculum vulgare	Herbs and Spices
BXGF00090	Star anise	Illicium verum	Herbs and Spices
BXGF00818	Herbs and Spices		Herbs and Spices
BXGF01346	Aquilaria agallochum	Aquilaria agallochum	Medicinal Plant
BXGF01426	Cornus officinalis	Cornus officinalis	Medicinal Plant
BXGF01856	Aquilaria sinensis	Aquilaria sinensis	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}