acompound

Showing entry for 4-Ethylresorcinol

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0051077
Compound Name	4-Ethylresorcinol
Structure
Formula	C8H10O2
InchiKey	VGMJYYDKPUPTID-UHFFFAOYSA-N
SMILES	CCc1ccc(cc1O)O
Inchi	InChI=1S/C8H10O2/c1-2-6-3-4-7(9)5-8(6)10/h3-5,9-10H,2H2,1H3
IUPAC	4-ethylbenzene-1,3-diol
Molecular Weight	138.07
Pubchem Id	17927
Chembl Id	CHEMBL2332776

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	BXGT004563	Polyphenol oxidase 2	reviewed		PPO2	-	1900	-	-
reviewed	BXGT004563	Polyphenol oxidase 2	reviewed		PPO2	-	1100	-	-

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
O42713	BXGT004563	Polyphenol oxidase 2	reviewed	-	PPO2	IC50	'='	1100	nM
O42713	BXGT004563	Polyphenol oxidase 2	reviewed	-	PPO2	Activity	-	-	-
P14679	BXGT008039	Tyrosinase	reviewed	Enzyme	TYR	Activity	'<'	1	%
O42713	BXGT004563	Polyphenol oxidase 2	reviewed	-	PPO2	Kcat/Km	'='	51	/mM/s
P14679	BXGT008039	Tyrosinase	reviewed	Enzyme	TYR	Activity	'='	1	%
P14679	BXGT008039	Tyrosinase	reviewed	Enzyme	TYR	Activity	'='	0	%
O42713	BXGT004563	Polyphenol oxidase 2	reviewed	-	PPO2	Inhibition	-	-	-
O42713	BXGT004563	Polyphenol oxidase 2	reviewed	-	PPO2	Kcat	'='	6	/s
O42713	BXGT004563	Polyphenol oxidase 2	reviewed	-	PPO2	Km	'='	117000	nM
O42713	BXGT004563	Polyphenol oxidase 2	reviewed	-	PPO2	IC50	'='	1900	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00206	Ginger	Zingiber officinale	Herbs and Spices
BXGF02049	Angelica sinensis	Angelica 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}