acompound

General Compound Information
BXGC Id	BXGC0007011
Compound Name	(R)-Perillaldehyde
Structure
Formula	C10H14O
InchiKey	RUMOYJJNUMEFDD-UHFFFAOYSA-N
SMILES	[H]C(=O)C1=CCC(CC1)C(C)=C
Inchi	InChI=1S/C10H14O/c1-8(2)10-5-3-9(7-11)4-6-10/h3,7,10H,1,4-6H2,2H3
IUPAC	4-(prop-1-en-2-yl)cyclohex-1-ene-1-carbaldehyde
Molecular Weight	150.22
Pubchem Id	16441
Chembl Id	CHEMBL469537

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	BXGT016509	Transient receptor potential cation channel subfamily A member 1	reviewed		Trpa1	-	-	-	19498
reviewed	BXGT005151	Transient receptor potential cation channel subfamily A member 1	reviewed	Ion channel	TRPA1	-	-	-	41000

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
O00519	BXGT003934	Fatty-acid amide hydrolase 1	reviewed	-	FAAH	Inhibition	'='	-7	%
O75762	BXGT005151	Transient receptor potential cation channel subfamily A member 1	reviewed	Ion channel	TRPA1	EC50	'='	41000	nM
Q6RI86	BXGT016509	Transient receptor potential cation channel subfamily A member 1	reviewed	-	Trpa1	Activity	-	-	-
Q6RI86	BXGT016509	Transient receptor potential cation channel subfamily A member 1	reviewed	-	Trpa1	Efficacy	'='	74	%
Q6RI86	BXGT016509	Transient receptor potential cation channel subfamily A member 1	reviewed	-	Trpa1	EC50	'='	41000	nM
Q6RI86	BXGT016509	Transient receptor potential cation channel subfamily A member 1	reviewed	-	Trpa1	EC50	'='	19498	nM
Q8R455	BXGT018684	Transient receptor potential cation channel subfamily M member 8	reviewed	-	Trpm8	Activity	-	-	-
Q8R455	BXGT018684	Transient receptor potential cation channel subfamily M member 8	reviewed	-	Trpm8	Inhibition	'='	64	%

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00015	Wild celery	Apium graveolens	Herbs and Spices
BXGF00043	Caraway	Carum carvi	Herbs and Spices
BXGF00053	Lime	Citrus aurantiifolia	Fruits
BXGF00054	Lemon	Citrus limon	Fruits
BXGF00055	Pummelo	Citrus maxima	Fruits
BXGF00056	Mandarin orange (Clementine, Tangerine)	Citrus reticulata	Fruits
BXGF00057	Sweet orange	Citrus sinensis	Fruits
BXGF00067	Cumin	Cuminum cyminum	Herbs and Spices
BXGF00112	Spearmint	Mentha spicata	Herbs and Spices
BXGF00139	Pepper (Spice)	Piper nigrum	Herbs and Spices
BXGF00204	Common grape	Vitis vinifera	Fruits
BXGF00206	Ginger	Zingiber officinale	Herbs and Spices
BXGF00811	Citrus		Fruits
BXGF00818	Herbs and Spices		Herbs and Spices
BXGF00871	Citrus unshiu	Citrus unshiu	Medicinal Plant
BXGF00946	Artemisia montana	Artemisia montana	Medicinal Plant
BXGF02106	Citrus medica	Citrus medica	Medicinal Plant
BXGF03078	Chrysanthemum x morifolium	Chrysanthemum x morifolium	Medicinal Plant
BXGF03327	Citrus trifoliata	Citrus trifoliata	Human Edible Plant
BXGF03953	Artemisia princeps	Artemisia princeps	Medicinal Plant
BXGF04382	Murraya paniculata	Murraya paniculata	Medicinal Plant
BXGF04611	Artemisia argyi	Artemisia argyi	Medicinal Plant
BXGF04982	Ligusticum chuanxiong	Ligusticum chuanxiong	Medicinal Plant
BXGF05000	Citrus reticulate	Citrus reticulate	Others
BXGF05431	Citrus natsudaidai	Citrus natsudaidai	Human Edible Plant
BXGF05819	Citrus aurantium	Citrus aurantium	Medicinal Plant
BXGF06070	Perilla frutescens	Perilla frutescens	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}