acompound

Showing entry for 4-Methoxybenzaldehyde

General Compound Information
BXGC Id	BXGC0000524
Compound Name	4-Methoxybenzaldehyde
Structure
Formula	C8H8O2
InchiKey	ZRSNZINYAWTAHE-UHFFFAOYSA-N
SMILES	COC1=CC=C(C=O)C=C1
Inchi	InChI=1S/C8H8O2/c1-10-8-4-2-7(6-9)3-5-8/h2-6H,1H3
IUPAC	4-methoxybenzaldehyde
Molecular Weight	136.15
Pubchem Id	31244
Chembl Id	CHEMBL161598

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

50139370

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	BXGT007716	Cytochrome P450 2A6	reviewed		CYP2A6	-	5150	-	-
reviewed	BXGT008039	Tyrosinase	reviewed	Enzyme	TYR	-	320000	-	-
reviewed	BXGT010872	Succinate-semialdehyde dehydrogenase, mitochondrial	reviewed	Enzyme	ALDH5A1	-	>1000000	-	-
reviewed	BXGT011907	4-aminobutyrate aminotransferase, mitochondrial	reviewed	Enzyme	ABAT	-	>1000000	-	-
reviewed	BXGT008610	Cytochrome P450 2A5	reviewed		Cyp2a5	-	5230	-	-

CHEMBL

CHEMBL161598

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
P00352	BXGT005510	Retinal dehydrogenase 1	reviewed	Enzyme	ALDH1A1	Potency	'='	7943	nM
P03372	BXGT006059	Estrogen receptor	reviewed	Nuclear receptor	ESR1	Activity	'='	48	%
P14679	BXGT008039	Tyrosinase	reviewed	Enzyme	TYR	IC50	'='	320000	nM
P03372	BXGT006059	Estrogen receptor	reviewed	Nuclear receptor	ESR1	Activity	'='	74	%
P11509	BXGT007716	Cytochrome P450 2A6	reviewed	-	CYP2A6	IC50	'='	5150	nM
P05177	BXGT006336	Cytochrome P450 1A2	reviewed	Enzyme	CYP1A2	IC50	'='	270000	nM
P51649	BXGT010872	Succinate-semialdehyde dehydrogenase, mitochondrial	reviewed	Enzyme	ALDH5A1	IC50	'>'	1000000	nM
P80404	BXGT011907	4-aminobutyrate aminotransferase, mitochondrial	reviewed	Enzyme	ABAT	IC50	'>'	1000000	nM
P83916	BXGT012025	Chromobox protein homolog 1	reviewed	Epigenetic regulator	CBX1	Potency	-	89125	nM
P20852	BXGT008610	Cytochrome P450 2A5	reviewed	-	Cyp2a5	IC50	'='	5230	nM
P10275	BXGT007552	Androgen receptor	reviewed	Nuclear receptor	AR	Potency	-	56234	nM
P10828	BXGT007624	Thyroid hormone receptor beta	reviewed	Nuclear receptor	THRB	Potency	-	17782	nM
P05164	BXGT006333	Myeloperoxidase	reviewed	Enzyme	MPO	Inhibition	-	-	-
Q03431	BXGT012714	Parathyroid hormone/parathyroid hormone-related peptide receptor	reviewed	G-protein coupled receptor	PTH1R	Potency	-	1122	nM
P37231	BXGT009972	Peroxisome proliferator-activated receptor gamma	reviewed	Nuclear receptor	PPARG	Potency	-	50118	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00011	Cashew nut	Anacardium occidentale	Nuts
BXGF00013	Dill	Anethum graveolens	Herbs and Spices
BXGF00019	Tarragon	Artemisia dracunculus	Herbs and Spices
BXGF00038	Tea	Camellia sinensis	Teas
BXGF00067	Cumin	Cuminum cyminum	Herbs and Spices
BXGF00082	Fennel	Foeniculum vulgare	Herbs and Spices
BXGF00090	Star anise	Illicium verum	Herbs and Spices
BXGF00111	Cornmint	Mentha arvensis	Herbs and Spices
BXGF00119	Sweet basil	Ocimum basilicum	Herbs and Spices
BXGF00137	Anise	Pimpinella anisum	Herbs and Spices
BXGF00138	Pine nut	Pinus	Nuts
BXGF00192	American cranberry	Vaccinium macrocarpon	Fruits
BXGF00194	Lingonberry	Vaccinium vitis-idaea	Fruits
BXGF00195	Vanilla	Vanilla	Herbs and Spices
BXGF00410	Roselle	Hibiscus sabdariffa	Herbs and Spices
BXGF00818	Herbs and Spices		Herbs and Spices
BXGF00995	Dalbergia rubiginosa	Dalbergia rubiginosa	Others
BXGF01081	Akebia trifoliata	Akebia trifoliata	Medicinal Plant
BXGF01245	Amomum villosum	Amomum villosum	Medicinal Plant
BXGF01324	Albizia julibrissin	Albizia julibrissin	Medicinal Plant
BXGF01451	Mesembryanthemum tortuosum	Mesembryanthemum tortuosum	Medicinal Plant
BXGF01733	Caryopteris mongholica	Caryopteris mongholica	Others
BXGF01743	Uncaria macrophylla	Uncaria macrophylla	Medicinal Plant
BXGF01767	Uncaria rhynchophylla	Uncaria rhynchophylla	Medicinal Plant
BXGF01804	Euphorbia kansui	Euphorbia kansui	Medicinal Plant
BXGF02004	Magnolia salicifolia	Magnolia salicifolia	Medicinal Plant
BXGF02200	Mappia foetida	Mappia foetida	Medicinal Plant
BXGF02616	Curcuma phaeocaulis	Curcuma phaeocaulis	Others
BXGF02673	Satureja atropatana	Satureja atropatana	Others
BXGF02847	Podocarpus elongata	Podocarpus elongata	Others
BXGF02927	Akebia quinata	Akebia quinata	Medicinal Plant
BXGF03479	Bombax ceiba	Bombax ceiba	Medicinal Plant
BXGF03536	Curcuma kwangsiensis	Curcuma kwangsiensis	Medicinal Plant
BXGF04087	Erysimum odoratum	Erysimum odoratum	Others
BXGF04092	Heterotheca inuloides	Heterotheca inuloides	Medicinal Plant
BXGF04098	Delphinium andersoni	Delphinium andersoni	Others
BXGF04126	Vismia jefensis	Vismia jefensis	Others
BXGF04142	Angelica tarokoensis	Angelica tarokoensis	Others
BXGF04147	Swertia delavayi	Swertia delavayi	Others
BXGF04165	Epimedium davidii	Epimedium davidii	Medicinal Plant
BXGF04168	Globba malaccensis	Globba malaccensis	Medicinal Plant
BXGF04173	Curcuma wenyujin	Curcuma wenyujin	Others
BXGF04175	Diphasia angolensis	Diphasia angolensis	Others
BXGF04182	Knightia excelsa	Knightia excelsa	Medicinal Plant
BXGF04199	Isodon japonicus	Isodon japonicus	Medicinal Plant
BXGF04207	Solanum acaule	Solanum acaule	Others
BXGF04216	Frullania tamarisci	Frullania tamarisci	Others
BXGF04217	Agastache rugosa	Agastache rugosa	Medicinal Plant
BXGF04221	Alangium premnifolium	Alangium premnifolium	Others
BXGF04233	Saussurea carthamoides	Saussurea carthamoides	Others
BXGF04250	Galenia africana	Galenia africana	Medicinal Plant
BXGF04264	Micromeria pineolens	Micromeria pineolens	Others
BXGF04269	Gnidia lamprantha	Gnidia lamprantha	Medicinal Plant
BXGF04276	Ilex amara	Ilex amara	Others
BXGF04295	Leonurus glaucescens	Leonurus glaucescens	Medicinal Plant
BXGF04342	Salacia madagascariensis	Salacia madagascariensis	Human Edible Plant
BXGF04343	Maba buxifolia	Maba buxifolia	Medicinal Plant
BXGF04540	Distemonanthus benthamianus	Distemonanthus benthamianus	Medicinal Plant
BXGF04590	Asplenium adiantum-nigrum	Asplenium adiantum-nigrum	Medicinal Plant
BXGF04680	Eschweilera coriacea	Eschweilera coriacea	Human Edible Plant
BXGF04777	Quercus sessiliflora	Quercus sessiliflora	Others
BXGF04864	Uncaria sinensis	Uncaria sinensis	Medicinal Plant
BXGF05081	Agastache rugosus	Agastache rugosus	Medicinal Plant
BXGF05140	Amomum neoaurantiacum	Amomum neoaurantiacum	Others
BXGF05159	Eucalyptus cladocalyx	Eucalyptus cladocalyx	Medicinal Plant
BXGF05354	Tabebuia avellanedae	Tabebuia avellanedae	Medicinal Plant
BXGF05480	Lepidium draba	Lepidium draba	Medicinal Plant
BXGF05510	Ulva pertusa	Ulva pertusa	Medicinal Plant
BXGF05555	Anchusa officinalis	Anchusa officinalis	Medicinal Plant
BXGF05688	Salvadora persica	Salvadora persica	Medicinal Plant
BXGF05934	Curcuma zedoaria	Curcuma zedoaria	Medicinal Plant
BXGF06238	Gardenia jasminoides	Gardenia jasminoides	Medicinal Plant
BXGF06321	Peltodon longipes	Peltodon longipes	Others

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}