acompound

Showing entry for 3,4-Dihydroxybenzaldehyde

General Compound Information
BXGC Id	BXGC0005795
Compound Name	3,4-Dihydroxybenzaldehyde
Structure
Formula	C7H6O3
InchiKey	IBGBGRVKPALMCQ-UHFFFAOYSA-N
SMILES	OC1=CC=C(C=O)C=C1O
Inchi	InChI=1S/C7H6O3/c8-4-5-1-2-6(9)7(10)3-5/h1-4,9-10H
IUPAC	3,4-dihydroxybenzaldehyde
Molecular Weight	138.12
Pubchem Id	8768
Chembl Id	CHEMBL222021

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

H6N

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
Q9M602	BXGT024268	O-methyltransferase	unreviewed	omt1	-	-	-	-	-

Binding DB

50192743

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	-	0.4	-	-

CHEMBL

CHEMBL222021

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	'='	0	ug.mL-1
O42713	BXGT004563	Polyphenol oxidase 2	reviewed	-	PPO2	Inhibition	'='	8	%
O42713	BXGT004563	Polyphenol oxidase 2	reviewed	-	PPO2	Inhibition	'='	2	%
O42713	BXGT004563	Polyphenol oxidase 2	reviewed	-	PPO2	Inhibition	'='	27	%
O42713	BXGT004563	Polyphenol oxidase 2	reviewed	-	PPO2	Inhibition	-	-	-
O94925	BXGT005342	Glutaminase kidney isoform, mitochondrial	reviewed	Enzyme	GLS	Potency	-	35481	nM
B2RXH2	BXGT002006	Lysine-specific demethylase 4E	reviewed	-	KDM4E	Potency	'='	4466	nM
Q9F4F7	BXGT020344	4'-phosphopantetheinyl transferase ffp	reviewed	-	ffp	Potency	'='	31622	nM
Q9UIF8	BXGT021718	Bromodomain adjacent to zinc finger domain protein 2B	reviewed	-	BAZ2B	Potency	-	56234	nM
O42713	BXGT004563	Polyphenol oxidase 2	reviewed	-	PPO2	Inhibition	'='	3	%
O42713	BXGT004563	Polyphenol oxidase 2	reviewed	-	PPO2	Inhibition	'='	13	%
Q9UNA4	BXGT021785	DNA polymerase iota	reviewed	-	POLI	Potency	-	39810	nM
O97447	BXGT005436	Putative fructose-1,6-bisphosphate aldolase	unreviewed	-	ald	Potency	'='	7924	nM
O42713	BXGT004563	Polyphenol oxidase 2	reviewed	-	PPO2	Inhibition	'<'	20	%
O75164	BXGT005104	Lysine-specific demethylase 4A	reviewed	-	KDM4A	Potency	-	22387	nM
Q96KQ7	BXGT019687	Histone-lysine N-methyltransferase EHMT2	reviewed	Epigenetic regulator	EHMT2	Potency	-	707	nM
Q96EB6	BXGT019646	NAD-dependent protein deacetylase sirtuin-1	reviewed	Epigenetic regulator	SIRT1	Activity	-	-	-
P51151	BXGT010837	Ras-related protein Rab-9A	reviewed	-	RAB9A	Potency	'='	3162	nM
O01945	BXGT003953	Collagen	unreviewed	-		Activity	'='	73	%
O01945	BXGT003953	Collagen	unreviewed	-		Activity	'='	72	%
O01945	BXGT003953	Collagen	unreviewed	-		Activity	'='	89	%
P05164	BXGT006333	Myeloperoxidase	reviewed	Enzyme	MPO	Inhibition	-	-	-
P18031	BXGT008369	Tyrosine-protein phosphatase non-receptor type 1	reviewed	-	PTPN1	Inhibition	'='	29	%

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00049	Chicory	Cichorium intybus	Vegetables
BXGF00079	Common buckwheat	Fagopyrum esculentum	Cereals and cereal products
BXGF00103	Lichee	Litchi chinensis	Fruits
BXGF00113	Peppermint	Mentha X piperita	Herbs and Spices
BXGF00129	Parsnip	Pastinaca sativa	Vegetables
BXGF00181	Dandelion	Taraxacum officinale	Herbs and Spices
BXGF00204	Common grape	Vitis vinifera	Fruits
BXGF00213	European cranberry	Vaccinium oxycoccos	Fruits
BXGF00292	Butternut squash	Cucurbita moschata	Gourds
BXGF00570	Grape wine		Beverages
BXGF00585	Vinegar		Baking goods
BXGF00870	Othonna sedifolia	Othonna sedifolia	Others
BXGF00910	Glechoma longituba	Glechoma longituba	Medicinal Plant
BXGF00931	Ipomoea digitata	Ipomoea digitata	Medicinal Plant
BXGF00945	Chrysanthemum sinense	Chrysanthemum sinense	Others
BXGF00959	Artemisia hanseniana	Artemisia hanseniana	Others
BXGF01034	Annona cornifolia	Annona cornifolia	Human Edible Plant
BXGF01070	Himalaiella deltoidea	Himalaiella deltoidea	Others
BXGF01145	Pterocarpus officinalis	Pterocarpus officinalis	Medicinal Plant
BXGF01159	Kopsia grandifolia	Kopsia grandifolia	Others
BXGF01174	Salvia syriaca	Salvia syriaca	Others
BXGF01177	Vernonia lanuginosa	Vernonia lanuginosa	Others
BXGF01188	Calycanthus floridus	Calycanthus floridus	Medicinal Plant
BXGF01204	Solanum laxum	Solanum laxum	Medicinal Plant
BXGF01215	Cirsium setosum	Cirsium setosum	Medicinal Plant
BXGF01281	Ledebouria socialis	Ledebouria socialis	Others
BXGF01315	Ipomoea purpurea	Ipomoea purpurea	Medicinal Plant
BXGF01319	Adenia globosa	Adenia globosa	Others
BXGF01361	Lycopus europaeus	Lycopus europaeus	Medicinal Plant
BXGF01400	Dipterocarpus dyeri	Dipterocarpus dyeri	Others
BXGF01403	Aglaia grandis	Aglaia grandis	Medicinal Plant
BXGF01433	Catunaregam tomentosa	Catunaregam tomentosa	Human Edible Plant
BXGF01443	Trachycarpus fortunei	Trachycarpus fortunei	Medicinal Plant
BXGF01456	Eucalyptus melliodora	Eucalyptus melliodora	Others
BXGF01461	Liriodendron tulipifera	Liriodendron tulipifera	Medicinal Plant
BXGF01518	Ipomoea cairica	Ipomoea cairica	Medicinal Plant
BXGF01555	Scutellaria amoena	Scutellaria amoena	Medicinal Plant
BXGF01614	Goniothalamus malayanus	Goniothalamus malayanus	Others
BXGF01668	Taraxacum platycarpum	Taraxacum platycarpum	Medicinal Plant
BXGF01699	Ceanothus velutinus	Ceanothus velutinus	Medicinal Plant
BXGF01732	Garcinia scortechinii	Garcinia scortechinii	Others
BXGF01756	Apollonias barbujana	Apollonias barbujana	Others
BXGF01781	Chlorophytum borivilianum	Chlorophytum borivilianum	Medicinal Plant
BXGF01832	Dalbergia ecastaphyllum	Dalbergia ecastaphyllum	Medicinal Plant
BXGF01834	Lysimachia mauritiana	Lysimachia mauritiana	Others
BXGF01868	Vitex negundo	Vitex negundo	Medicinal Plant
BXGF01883	Swertia franchetiana	Swertia franchetiana	Medicinal Plant
BXGF01940	Salvia trijuga	Salvia trijuga	Medicinal Plant
BXGF01989	Helipterum roseum	Helipterum roseum	Others
BXGF02050	Hedysarum connatum	Hedysarum connatum	Others
BXGF02088	Zanthoxylum tetraspermum	Zanthoxylum tetraspermum	Medicinal Plant
BXGF02125	Artemisia assoana	Artemisia assoana	Others
BXGF02152	Taraxacum borealisinense	Taraxacum borealisinense	Others
BXGF02183	Dumortiera hirsuta	Dumortiera hirsuta	Medicinal Plant
BXGF02221	Phlojodicarpus sibiricus	Phlojodicarpus sibiricus	Medicinal Plant
BXGF02246	Lepisorus ussuriensis	Lepisorus ussuriensis	Medicinal Plant
BXGF02256	Rumex chalepensis	Rumex chalepensis	Others
BXGF02295	Alstonia spathulata	Alstonia spathulata	Others
BXGF02316	Isodon lophanthoides	Isodon lophanthoides	Medicinal Plant
BXGF02326	Phoebe pittieri	Phoebe pittieri	Others
BXGF02361	Hypericum laricifolium	Hypericum laricifolium	Medicinal Plant
BXGF02388	Ipomoea nil	Ipomoea nil	Medicinal Plant
BXGF02397	Pithecellobium racemosum	Pithecellobium racemosum	Others
BXGF02410	Adiantum lunulatum	Adiantum lunulatum	Medicinal Plant
BXGF02460	Peltostigma guatemalense	Peltostigma guatemalense	Others
BXGF02491	Acacia adunca	Acacia adunca	Others
BXGF02509	Xanthium sibiricum	Xanthium sibiricum	Medicinal Plant
BXGF02515	Viguiera incana	Viguiera incana	Others
BXGF02529	Astragalus sempervirens	Astragalus sempervirens	Others
BXGF02554	Marrubium anisodon	Marrubium anisodon	Medicinal Plant
BXGF02593	Wikstroemia retusa	Wikstroemia retusa	Others
BXGF02596	Fragaria vesca	Fragaria vesca	Medicinal Plant
BXGF02606	Naucleopsis ternstroemiiflora	Naucleopsis ternstroemiiflora	Others
BXGF02726	Clerodendranthus spicatus	Clerodendranthus spicatus	Others
BXGF02815	Pinellia ternata	Pinellia ternata	Medicinal Plant
BXGF02859	Bulbinella floribunda	Bulbinella floribunda	Others
BXGF02889	Salvia prionitis	Salvia prionitis	Medicinal Plant
BXGF02956	Forsythia viridissima	Forsythia viridissima	Medicinal Plant
BXGF02962	Melilotus officinalis	Melilotus officinalis	Medicinal Plant
BXGF03090	Lasianthus fordii	Lasianthus fordii	Others
BXGF03117	Myoporum platycarpum	Myoporum platycarpum	Medicinal Plant
BXGF03247	Anastatica hierochuntica	Anastatica hierochuntica	Medicinal Plant
BXGF03253	Forsythia suspensa	Forsythia suspensa	Medicinal Plant
BXGF03300	Blumea eriantha	Blumea eriantha	Medicinal Plant
BXGF03374	Cipadessa fruticosa	Cipadessa fruticosa	Others
BXGF03444	Gastrodia elata	Gastrodia elata	Medicinal Plant
BXGF03484	Ranunculus sceleratus	Ranunculus sceleratus	Medicinal Plant
BXGF03602	Orobanche coerulescens	Orobanche coerulescens	Medicinal Plant
BXGF03630	Taraxacum coreanum	Taraxacum coreanum	Others
BXGF03649	Palaquium canaliculatum	Palaquium canaliculatum	Others
BXGF03665	Physalis sordida	Physalis sordida	Others
BXGF03785	Taxus drupacea	Taxus drupacea	Others
BXGF03803	Ilex brevicuspis	Ilex brevicuspis	Human Edible Plant
BXGF03831	Acrisione denticulata	Acrisione denticulata	Others
BXGF03845	Senecio heliopsis	Senecio heliopsis	Others
BXGF03851	Berberis orthobotrys	Berberis orthobotrys	Medicinal Plant
BXGF03871	Codium dwarkense	Codium dwarkense	Others
BXGF03878	Achillea biebersteinii	Achillea biebersteinii	Medicinal Plant
BXGF03904	Euphorbia formosana	Euphorbia formosana	Others
BXGF03912	Diplazium esculentum	Diplazium esculentum	Medicinal Plant
BXGF03919	Xanthium strumarium	Xanthium strumarium	Medicinal Plant
BXGF03944	Ongokea gore	Ongokea gore	Medicinal Plant
BXGF03946	Sanicula epipactis	Sanicula epipactis	Others
BXGF03947	Rumex maritimus	Rumex maritimus	Medicinal Plant
BXGF03958	Euonymus laxiflorus	Euonymus laxiflorus	Others
BXGF03989	Scopolia atropoides	Scopolia atropoides	Others
BXGF04005	Caryocar villosum	Caryocar villosum	Medicinal Plant
BXGF04013	Ocimum gratissimum	Ocimum gratissimum	Medicinal Plant
BXGF04019	Glochidion philippicum	Glochidion philippicum	Others
BXGF04024	Ceriops decandra	Ceriops decandra	Medicinal Plant
BXGF04027	Solidago petiolaris	Solidago petiolaris	Others
BXGF04034	Zaluzania grayana	Zaluzania grayana	Others
BXGF04052	Zanthoxylum acutifolium	Zanthoxylum acutifolium	Medicinal Plant
BXGF04064	Rumex japonicus	Rumex japonicus	Medicinal Plant
BXGF04071	Archidendron ellipticum	Archidendron ellipticum	Others
BXGF04082	Tabernaemontana divaricata	Tabernaemontana divaricata	Medicinal Plant
BXGF04122	Glechoma grandis	Glechoma grandis	Medicinal Plant
BXGF04134	Commiphora mukul	Commiphora mukul	Medicinal Plant
BXGF04209	Chaenomeles sinensis	Chaenomeles sinensis	Medicinal Plant
BXGF04300	Tetrapanax papyrifer	Tetrapanax papyrifer	Medicinal Plant
BXGF04310	Taraxacum mongolicum	Taraxacum mongolicum	Medicinal Plant
BXGF04323	Orobanche pycnostachya	Orobanche pycnostachya	Others
BXGF04428	Baccharis dracunculifolia	Baccharis dracunculifolia	Medicinal Plant
BXGF04693	Pyrus calleryana	Pyrus calleryana	Medicinal Plant
BXGF04934	Salvia przewalskll	Salvia przewalskll	Others
BXGF05096	Aconitum leucostomum	Aconitum leucostomum	Medicinal Plant
BXGF05187	Calostephane divaricata	Calostephane divaricata	Others
BXGF05200	Aquilegia ecalcarata	Aquilegia ecalcarata	Medicinal Plant
BXGF05235	Phlomoides rotata	Phlomoides rotata	Others
BXGF05316	Persea mexicana	Persea mexicana	Others
BXGF05330	Arum ternatum thunb	Arum ternatum thunb	Others
BXGF05399	Zanthoxylum myriacanthum	Zanthoxylum myriacanthum	Medicinal Plant
BXGF05456	Anaphalis araneosa	Anaphalis araneosa	Others
BXGF05492	Bhesa nitidissima	Bhesa nitidissima	Others
BXGF05526	Salvia miltiorrhiza	Salvia miltiorrhiza	Medicinal Plant
BXGF05693	Picea jezoensis var. jezoensis	Picea jezoensis var. jezoensis	Medicinal Plant
BXGF05724	Rothmannia wittii	Rothmannia wittii	Medicinal Plant
BXGF05728	Persicaria perfoliata	Persicaria perfoliata	Medicinal Plant
BXGF05742	Caragana aurantiaca	Caragana aurantiaca	Others
BXGF05767	Gardenia tubifera	Gardenia tubifera	Medicinal Plant
BXGF05845	Panax innovans	Panax innovans	Others
BXGF05846	Ranzania japonica	Ranzania japonica	Others
BXGF05862	Premna odorata	Premna odorata	Medicinal Plant
BXGF05904	Impatiens edgeworthii	Impatiens edgeworthii	Others
BXGF05940	Artemisia kurramensis	Artemisia kurramensis	Others
BXGF05956	Blumea mollis	Blumea mollis	Medicinal Plant
BXGF05965	Episcia cupreata	Episcia cupreata	Others
BXGF06037	Cotyledon secunda	Cotyledon secunda	Others
BXGF06070	Perilla frutescens	Perilla frutescens	Medicinal Plant
BXGF06108	Centipeda minima	Centipeda minima	Medicinal Plant
BXGF06140	Tanacetum parthenium	Tanacetum parthenium	Medicinal Plant
BXGF06186	Jasonia candicans	Jasonia candicans	Others
BXGF06227	Rauvolfia vomitoria	Rauvolfia vomitoria	Medicinal Plant
BXGF06237	Gnetum latifolium	Gnetum latifolium	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}