acompound

Showing entry for [6]-Paradol

General Compound Information
BXGC Id	BXGC0002024
Compound Name	[6]-Paradol
Structure
Formula	C17H26O3
InchiKey	CZNLTCTYLMYLHL-UHFFFAOYSA-N
SMILES	CCCCCCCC(=O)CCC1=CC(OC)=C(O)C=C1
Inchi	InChI=1S/C17H26O3/c1-3-4-5-6-7-8-15(18)11-9-14-10-12-16(19)17(13-14)20-2/h10,12-13,19H,3-9,11H2,1-2H3
IUPAC	1-(4-hydroxy-3-methoxyphenyl)decan-3-one
Molecular Weight	278.39
Pubchem Id	94378
Chembl Id	CHEMBL2071440

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

CHEMBL2071440

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
P05177	BXGT006336	Cytochrome P450 1A2	reviewed	Enzyme	CYP1A2	Inhibition	-	-	-
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Activity	'='	62	%
P33261	BXGT009707	Cytochrome P450 2C19	reviewed	-	CYP2C19	IC50	'='	5800	nM
P10635	BXGT007595	Cytochrome P450 2D6	reviewed	-	CYP2D6	Activity	'='	103	%
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Activity	'='	108	%
P11509	BXGT007716	Cytochrome P450 2A6	reviewed	-	CYP2A6	IC50	'>'	30000	nM
P20813	BXGT008603	Cytochrome P450 2B6	reviewed	-	CYP2B6	Activity	'='	45	%
P10632	BXGT007592	Cytochrome P450 2C8	reviewed	-	CYP2C8	Activity	'='	77	%
P10632	BXGT007592	Cytochrome P450 2C8	reviewed	-	CYP2C8	IC50	'='	5100	nM
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Activity	'='	72	%
P05177	BXGT006336	Cytochrome P450 1A2	reviewed	Enzyme	CYP1A2	Activity	'='	97	%
P05177	BXGT006336	Cytochrome P450 1A2	reviewed	Enzyme	CYP1A2	Activity	'='	59	%
P05177	BXGT006336	Cytochrome P450 1A2	reviewed	Enzyme	CYP1A2	IC50	'='	7100	nM
P11712	BXGT007738	Cytochrome P450 2C9	reviewed	-	CYP2C9	Activity	'='	120	%
P10635	BXGT007595	Cytochrome P450 2D6	reviewed	-	CYP2D6	Activity	'='	53	%
P05177	BXGT006336	Cytochrome P450 1A2	reviewed	Enzyme	CYP1A2	IC50	'='	21400	nM
P11509	BXGT007716	Cytochrome P450 2A6	reviewed	-	CYP2A6	Activity	'='	104	%
P11712	BXGT007738	Cytochrome P450 2C9	reviewed	-	CYP2C9	Activity	'='	52	%
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Activity	'='	63	%
P11712	BXGT007738	Cytochrome P450 2C9	reviewed	-	CYP2C9	Activity	'='	76	%
P20813	BXGT008603	Cytochrome P450 2B6	reviewed	-	CYP2B6	IC50	'='	6200	nM
P05177	BXGT006336	Cytochrome P450 1A2	reviewed	Enzyme	CYP1A2	Activity	'='	97	%
P11509	BXGT007716	Cytochrome P450 2A6	reviewed	-	CYP2A6	Activity	'='	96	%
P20813	BXGT008603	Cytochrome P450 2B6	reviewed	-	CYP2B6	Activity	'='	88	%
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Activity	'='	103	%
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Activity	'='	75	%
P11509	BXGT007716	Cytochrome P450 2A6	reviewed	-	CYP2A6	Activity	'='	103	%
P11712	BXGT007738	Cytochrome P450 2C9	reviewed	-	CYP2C9	Activity	'='	60	%
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	IC50	'>'	30000	nM
P10635	BXGT007595	Cytochrome P450 2D6	reviewed	-	CYP2D6	IC50	'>'	30000	nM
P10632	BXGT007592	Cytochrome P450 2C8	reviewed	-	CYP2C8	Activity	'='	82	%
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Activity	'='	65	%
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Activity	'='	58	%
P05177	BXGT006336	Cytochrome P450 1A2	reviewed	Enzyme	CYP1A2	Activity	'='	82	%
P05177	BXGT006336	Cytochrome P450 1A2	reviewed	Enzyme	CYP1A2	IC50	'='	19600	nM
P33261	BXGT009707	Cytochrome P450 2C19	reviewed	-	CYP2C19	Activity	'='	88	%
P11509	BXGT007716	Cytochrome P450 2A6	reviewed	-	CYP2A6	Activity	'='	80	%
P10635	BXGT007595	Cytochrome P450 2D6	reviewed	-	CYP2D6	Activity	'='	92	%
P10635	BXGT007595	Cytochrome P450 2D6	reviewed	-	CYP2D6	Activity	'='	80	%
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Activity	'='	96	%
P05177	BXGT006336	Cytochrome P450 1A2	reviewed	Enzyme	CYP1A2	Activity	'='	96	%
P11712	BXGT007738	Cytochrome P450 2C9	reviewed	-	CYP2C9	IC50	'='	10500	nM
P33261	BXGT009707	Cytochrome P450 2C19	reviewed	-	CYP2C19	Activity	'='	72	%
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Activity	'='	88	%
P20813	BXGT008603	Cytochrome P450 2B6	reviewed	-	CYP2B6	IC50	'='	15400	nM
P10632	BXGT007592	Cytochrome P450 2C8	reviewed	-	CYP2C8	Activity	'='	58	%
P10635	BXGT007595	Cytochrome P450 2D6	reviewed	-	CYP2D6	Activity	'='	76	%
P05177	BXGT006336	Cytochrome P450 1A2	reviewed	Enzyme	CYP1A2	Activity	'='	100	%
P33261	BXGT009707	Cytochrome P450 2C19	reviewed	-	CYP2C19	IC50	'='	3600	nM
P10635	BXGT007595	Cytochrome P450 2D6	reviewed	-	CYP2D6	Activity	'='	87	%
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Activity	'='	87	%
P33261	BXGT009707	Cytochrome P450 2C19	reviewed	-	CYP2C19	Activity	'='	36	%
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Activity	'='	97	%
P20813	BXGT008603	Cytochrome P450 2B6	reviewed	-	CYP2B6	Activity	'='	81	%
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Activity	'='	100	%
P11509	BXGT007716	Cytochrome P450 2A6	reviewed	-	CYP2A6	Activity	'='	83	%
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Activity	'='	91	%
P33261	BXGT009707	Cytochrome P450 2C19	reviewed	-	CYP2C19	Inhibition	-	-	-
P05177	BXGT006336	Cytochrome P450 1A2	reviewed	Enzyme	CYP1A2	Activity	'='	42	%
P20813	BXGT008603	Cytochrome P450 2B6	reviewed	-	CYP2B6	Inhibition	-	-	-
P11509	BXGT007716	Cytochrome P450 2A6	reviewed	-	CYP2A6	Activity	'='	77	%
P11712	BXGT007738	Cytochrome P450 2C9	reviewed	-	CYP2C9	Activity	'='	68	%
P20813	BXGT008603	Cytochrome P450 2B6	reviewed	-	CYP2B6	Activity	'='	93	%
P20813	BXGT008603	Cytochrome P450 2B6	reviewed	-	CYP2B6	Activity	'='	53	%
P10632	BXGT007592	Cytochrome P450 2C8	reviewed	-	CYP2C8	Activity	'='	40	%
P11712	BXGT007738	Cytochrome P450 2C9	reviewed	-	CYP2C9	Activity	'='	81	%
P11712	BXGT007738	Cytochrome P450 2C9	reviewed	-	CYP2C9	Activity	'='	46	%
P05177	BXGT006336	Cytochrome P450 1A2	reviewed	Enzyme	CYP1A2	Activity	'='	72	%
P10635	BXGT007595	Cytochrome P450 2D6	reviewed	-	CYP2D6	Activity	'='	99	%
P33261	BXGT009707	Cytochrome P450 2C19	reviewed	-	CYP2C19	Activity	'='	67	%
P20813	BXGT008603	Cytochrome P450 2B6	reviewed	-	CYP2B6	Activity	'='	37	%
P11712	BXGT007738	Cytochrome P450 2C9	reviewed	-	CYP2C9	Activity	'='	93	%
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Activity	'='	71	%
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	IC50	'='	30000	nM
P11509	BXGT007716	Cytochrome P450 2A6	reviewed	-	CYP2A6	Activity	'='	96	%
P20813	BXGT008603	Cytochrome P450 2B6	reviewed	-	CYP2B6	Activity	'='	54	%
P20813	BXGT008603	Cytochrome P450 2B6	reviewed	-	CYP2B6	IC50	'='	6300	nM
P11509	BXGT007716	Cytochrome P450 2A6	reviewed	-	CYP2A6	Activity	'='	81	%
P10632	BXGT007592	Cytochrome P450 2C8	reviewed	-	CYP2C8	Activity	'='	45	%
P11712	BXGT007738	Cytochrome P450 2C9	reviewed	-	CYP2C9	Activity	'='	30	%
P33261	BXGT009707	Cytochrome P450 2C19	reviewed	-	CYP2C19	Activity	'='	42	%
P33261	BXGT009707	Cytochrome P450 2C19	reviewed	-	CYP2C19	IC50	'='	17600	nM
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Activity	'='	103	%
P05177	BXGT006336	Cytochrome P450 1A2	reviewed	Enzyme	CYP1A2	Activity	'='	76	%
P11509	BXGT007716	Cytochrome P450 2A6	reviewed	-	CYP2A6	Activity	'='	79	%
P10632	BXGT007592	Cytochrome P450 2C8	reviewed	-	CYP2C8	IC50	'='	8300	nM
P11712	BXGT007738	Cytochrome P450 2C9	reviewed	-	CYP2C9	IC50	'='	9900	nM
P10632	BXGT007592	Cytochrome P450 2C8	reviewed	-	CYP2C8	Inhibition	-	-	-
P33261	BXGT009707	Cytochrome P450 2C19	reviewed	-	CYP2C19	Activity	'='	81	%
P10632	BXGT007592	Cytochrome P450 2C8	reviewed	-	CYP2C8	IC50	'='	3800	nM
P20813	BXGT008603	Cytochrome P450 2B6	reviewed	-	CYP2B6	Activity	'='	68	%
P20813	BXGT008603	Cytochrome P450 2B6	reviewed	-	CYP2B6	Activity	'='	65	%
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Activity	'='	77	%
P11509	BXGT007716	Cytochrome P450 2A6	reviewed	-	CYP2A6	Activity	'='	102	%
P11712	BXGT007738	Cytochrome P450 2C9	reviewed	-	CYP2C9	Activity	'='	72	%
P33261	BXGT009707	Cytochrome P450 2C19	reviewed	-	CYP2C19	Activity	'='	102	%
P11712	BXGT007738	Cytochrome P450 2C9	reviewed	-	CYP2C9	Inhibition	-	-	-
P05177	BXGT006336	Cytochrome P450 1A2	reviewed	Enzyme	CYP1A2	Activity	'='	79	%
P11509	BXGT007716	Cytochrome P450 2A6	reviewed	-	CYP2A6	Activity	'='	102	%
P10632	BXGT007592	Cytochrome P450 2C8	reviewed	-	CYP2C8	Activity	'='	35	%
P33261	BXGT009707	Cytochrome P450 2C19	reviewed	-	CYP2C19	Activity	'='	98	%
P10635	BXGT007595	Cytochrome P450 2D6	reviewed	-	CYP2D6	Activity	'='	75	%
P10635	BXGT007595	Cytochrome P450 2D6	reviewed	-	CYP2D6	Activity	'='	74	%
P20813	BXGT008603	Cytochrome P450 2B6	reviewed	-	CYP2B6	Activity	'='	79	%
P10632	BXGT007592	Cytochrome P450 2C8	reviewed	-	CYP2C8	Activity	'='	61	%
P33261	BXGT009707	Cytochrome P450 2C19	reviewed	-	CYP2C19	Activity	'='	78	%
P20813	BXGT008603	Cytochrome P450 2B6	reviewed	-	CYP2B6	Activity	'='	77	%
P11712	BXGT007738	Cytochrome P450 2C9	reviewed	-	CYP2C9	Activity	'='	76	%
P20813	BXGT008603	Cytochrome P450 2B6	reviewed	-	CYP2B6	Activity	'='	63	%
P10632	BXGT007592	Cytochrome P450 2C8	reviewed	-	CYP2C8	Activity	'='	88	%
P11509	BXGT007716	Cytochrome P450 2A6	reviewed	-	CYP2A6	Activity	'='	83	%
P10632	BXGT007592	Cytochrome P450 2C8	reviewed	-	CYP2C8	Activity	'='	49	%
P10635	BXGT007595	Cytochrome P450 2D6	reviewed	-	CYP2D6	Activity	'='	89	%
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Activity	'='	83	%
P33261	BXGT009707	Cytochrome P450 2C19	reviewed	-	CYP2C19	Activity	'='	44	%
P11712	BXGT007738	Cytochrome P450 2C9	reviewed	-	CYP2C9	Activity	'='	78	%
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Activity	'='	48	%
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Activity	'='	93	%
P05177	BXGT006336	Cytochrome P450 1A2	reviewed	Enzyme	CYP1A2	Activity	'='	49	%
P05177	BXGT006336	Cytochrome P450 1A2	reviewed	Enzyme	CYP1A2	Activity	'='	35	%
P10632	BXGT007592	Cytochrome P450 2C8	reviewed	-	CYP2C8	Activity	'='	68	%
P11712	BXGT007738	Cytochrome P450 2C9	reviewed	-	CYP2C9	IC50	'='	13600	nM
P33261	BXGT009707	Cytochrome P450 2C19	reviewed	-	CYP2C19	Activity	'='	85	%
P33261	BXGT009707	Cytochrome P450 2C19	reviewed	-	CYP2C19	Activity	'='	51	%
P10635	BXGT007595	Cytochrome P450 2D6	reviewed	-	CYP2D6	Activity	'='	112	%
P10635	BXGT007595	Cytochrome P450 2D6	reviewed	-	CYP2D6	Activity	'='	60	%
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Activity	'='	88	%
P10632	BXGT007592	Cytochrome P450 2C8	reviewed	-	CYP2C8	Activity	'='	83	%
P10632	BXGT007592	Cytochrome P450 2C8	reviewed	-	CYP2C8	Activity	'='	56	%
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Activity	'='	110	%
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Activity	'='	89	%
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Activity	'='	95	%

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
BXGF00402	Opium poppy	Papaver somniferum	Herbs and Spices
BXGF00806	Alcoholic beverages		Beverages
BXGF00818	Herbs and Spices		Herbs and Spices
BXGF05001	Stephania cepharantha	Stephania cepharantha	Medicinal Plant
BXGF05448	Dryopteris crassirhizoma	Dryopteris crassirhizoma	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}