acompound

Showing entry for Propanoic acid

General Compound Information
BXGC Id	BXGC0004269
Compound Name	Propanoic acid
Structure
Formula	C3H6O2
InchiKey	XBDQKXXYIPTUBI-UHFFFAOYSA-N
SMILES	CCC(O)=O
Inchi	InChI=1S/C3H6O2/c1-2-3(4)5/h2H2,1H3,(H,4,5)
IUPAC	propanoic acid
Molecular Weight	74.08
Pubchem Id	1032
Chembl Id	CHEMBL14021

Targets of Information Source

DrugBank

DB03766

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
P10724	BXGT007606	Alanine racemase	reviewed	-	alr	approved; vet_approved	-
Q9NQX3	BXGT021172	Gephyrin	reviewed	-	GPHN	approved; vet_approved	-
P96965	BXGT012195	2-hydroxy-6-oxo-7-methylocta-2,4-dienoate hydrolase	unreviewed	-	cumD	approved; vet_approved	-

PDB

PPI

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
O31158	BXGT004385	Non-heme chloroperoxidase	reviewed	cpo	-	-	-	-	-
P04117	BXGT006149	Fatty acid-binding protein, adipocyte	reviewed	Fabp4	-	-	-	-	-
P01484	BXGT005757	Alpha-mammal toxin AaH2	reviewed		-	-	-	-	-
Q9HX49	BXGT020643	Uncharacterized protein	unreviewed	PA3967	-	-	-	-	-
P96965	BXGT012195	2-hydroxy-6-oxo-7-methylocta-2,4-dienoate hydrolase	unreviewed	cumD	-	-	-	-	-
Q39054	BXGT014369	Molybdopterin biosynthesis protein CNX1	reviewed	CNX1	-	-	-	-	-
P00698	BXGT005617	Lysozyme C	reviewed	LYZ	-	-	-	-	-
P10724	BXGT007606	Alanine racemase	reviewed	alr	-	20000000	-	-	-
P0AGL2	BXGT007378	Putative reactive intermediate deaminase TdcF	reviewed	tdcF	-	-	-	-	-
P63104	BXGT011499	14-3-3 protein zeta/delta	reviewed	YWHAZ	Chaperone	-	-	-	-
Q837J0	BXGT017471	Alanine racemase	unreviewed	alr	-	-	-	-	-
O66939	BXGT004968	D-lactate dehydrogenase	unreviewed	ldhA	-	-	-	-	-
Q93RE9	BXGT019522	Alcohol dehydrogenase	unreviewed	adh	-	-	-	-	-
P14780	BXGT008053	Matrix metalloproteinase-9	reviewed	MMP9	Enzyme	-	-	-	-
P11362	BXGT007693	Fibroblast growth factor receptor 1	reviewed	FGFR1	Kinase	-	-	-	-
O06961	BXGT003995	Propionate kinase	reviewed	tdcD	-	-	-	-	-
Q8Y775	BXGT019093	Lmo1422 protein	unreviewed	lmo1422	-	-	-	-	-
Q86W56	BXGT017624	Poly(ADP-ribose) glycohydrolase	reviewed	PARG	-	-	-	-	-
A0A0X1KHD1	BXGT000629	Esterase Est2	unreviewed		-	-	-	-	-
O86786	BXGT005252	Alanine racemase	reviewed	alr	-	-	-	-	-
Q76HN4	BXGT016857	Exo-beta-D-glucosaminidase	reviewed	glmA	-	-	-	-	-
O75164	BXGT005104	Lysine-specific demethylase 4A	reviewed	KDM4A	-	-	-	-	-
A3Z6M0	BXGT001204	Aldehyde decarbonylase	unreviewed	RS9917_12945	-	-	-	-	-
B1L2G5	BXGT001886	Bontoxilysin A	unreviewed	botA	-	-	-	-	-
Q72KD3	BXGT016750	Aldehyde dehydrogenase	unreviewed	TT_C0513	-	-	-	-	-
P00441	BXGT005540	Superoxide dismutase [Cu-Zn]	reviewed	SOD1	Enzyme	-	-	-	-
O14618	BXGT004076	Copper chaperone for superoxide dismutase	reviewed	CCS	Enzyme	-	-	-	-
Q7NDN8	BXGT017055	Proton-gated ion channel	reviewed	glvI	-	-	-	-	-
A0A1Y1BW67	BXGT024713	Ketosynthase	unreviewed	iga11	-	-	-	-	-
P0A8K1	BXGT024728	Phosphatidylserine decarboxylase proenzyme	reviewed	psd	-	-	-	-	-
Q9NZ08	BXGT021266	Endoplasmic reticulum aminopeptidase 1	reviewed	ERAP1	Enzyme	-	-	-	-
Q188Q3	BXGT025730	Beta-lactamase	unreviewed	CD630_04580	-	-	-	-	-
Q9HUP2	BXGT025759	ChoE	unreviewed	choE	-	-	-	-	-
P07140	BXGT006556	Acetylcholinesterase	reviewed	Ace	-	-	-	-	-

Binding DB

50082199

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	BXGT004180	Free fatty acid receptor 2	reviewed	G-protein coupled receptor	FFAR2	-	130000	-	-
reviewed	BXGT018912	Solute carrier family 22 member 6	reviewed		Slc22a6	8180000	-	-	-
reviewed	BXGT017282	Solute carrier family 22 member 20	reviewed		Slc22a20	281838	-	-	-

CHEMBL

CHEMBL14021

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
Q8VC69	BXGT018912	Solute carrier family 22 member 6	reviewed	-	Slc22a6	Ki	'='	8128305	nM
Q969S8	BXGT019613	Polyamine deacetylase HDAC10	reviewed	Epigenetic regulator	HDAC10	Activity	'='	80	%
Q9UKV0	BXGT021750	Histone deacetylase 9	reviewed	Epigenetic regulator	HDAC9	Activity	'='	80	%
P56524	BXGT011176	Histone deacetylase 4	reviewed	Epigenetic regulator	HDAC4	Activity	'='	80	%
Q96DB2	BXGT019639	Histone deacetylase 11	reviewed	Epigenetic regulator	HDAC11	Activity	'='	80	%
Q9BY41	BXGT020180	Histone deacetylase 8	reviewed	Epigenetic regulator	HDAC8	Activity	'='	80	%
Q8WUI4	BXGT018992	Histone deacetylase 7	reviewed	Epigenetic regulator	HDAC7	Activity	'='	80	%
Q9UQL6	BXGT021813	Histone deacetylase 5	reviewed	Epigenetic regulator	HDAC5	Activity	'='	80	%
Q92769	BXGT019370	Histone deacetylase 2	reviewed	Epigenetic regulator	HDAC2	Activity	'='	80	%
Q9UBN7	BXGT021658	Histone deacetylase 6	reviewed	Epigenetic regulator	HDAC6	Activity	'='	80	%
O15379	BXGT004159	Histone deacetylase 3	reviewed	Epigenetic regulator	HDAC3	Activity	'='	80	%
Q13547	BXGT013373	Histone deacetylase 1	reviewed	Epigenetic regulator	HDAC1	Activity	'='	80	%
Q8VC69	BXGT018912	Solute carrier family 22 member 6	reviewed	-	Slc22a6	Ki	'='	8180000	nM
P53987	BXGT011023	Monocarboxylate transporter 1	reviewed	-	Slc16a1	Activity	-	-	-
Q9UBT6	BXGT021664	DNA polymerase kappa	reviewed	-	POLK	Inhibition	-	-	-
O15552	BXGT004180	Free fatty acid receptor 2	reviewed	G-protein coupled receptor	FFAR2	EC50	'='	250000	nM
Q9UGP5	BXGT021689	DNA polymerase lambda	reviewed	Enzyme	POLL	Inhibition	-	-	-
O15552	BXGT004180	Free fatty acid receptor 2	reviewed	G-protein coupled receptor	FFAR2	Efficacy	'='	100	%
O15552	BXGT004180	Free fatty acid receptor 2	reviewed	G-protein coupled receptor	FFAR2	IC50	'='	130000	nM
Q80UJ1	BXGT017282	Solute carrier family 22 member 20	reviewed	-	Slc22a20	Ki	'='	279000	nM
Q80UJ1	BXGT017282	Solute carrier family 22 member 20	reviewed	-	Slc22a20	Ki	'='	281838	nM
O14843	BXGT004107	Free fatty acid receptor 3	reviewed	G-protein coupled receptor	FFAR3	EC50	'='	12000	nM
Q8VCK6	BXGT026135	Free fatty acid receptor 2	reviewed	-	Ffar2	EC50	'='	251188	nM
O15552	BXGT004180	Free fatty acid receptor 2	reviewed	G-protein coupled receptor	FFAR2	EC50	'='	257039	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00016	Peanut	Arachis hypogaea	Nuts
BXGF00017	Burdock	Arctium lappa	Vegetables
BXGF00038	Tea	Camellia sinensis	Teas
BXGF00040	Pepper (C. annuum)	Capsicum annuum	Vegetables
BXGF00042	Safflower	Carthamus tinctorius	Herbs and Spices
BXGF00057	Sweet orange	Citrus sinensis	Fruits
BXGF00074	Cardamom	Elettaria cardamomum	Herbs and Spices
BXGF00085	Soy bean	Glycine max	Soy
BXGF00087	Sea-buckthornberry	Hippophae rhamnoides	Fruits
BXGF00097	Sweet bay	Laurus nobilis	Herbs and Spices
BXGF00118	Nutmeg	Myristica fragrans	Herbs and Spices
BXGF00119	Sweet basil	Ocimum basilicum	Herbs and Spices
BXGF00130	Avocado	Persea americana	Vegetables
BXGF00137	Anise	Pimpinella anisum	Herbs and Spices
BXGF00144	Apricot	Prunus armeniaca	Fruits
BXGF00162	Red raspberry	Rubus idaeus	Fruits
BXGF00173	Garden tomato (var.)	Solanum lycopersicum var. lycopersicum	Vegetables
BXGF00181	Dandelion	Taraxacum officinale	Herbs and Spices
BXGF00182	Cocoa bean	Theobroma cacao	Cocoa and cocoa products
BXGF00337	Ginkgo nuts	Ginkgo biloba	Herbs and Spices
BXGF00369	Sacred lotus	Nelumbo nucifera	Vegetables
BXGF00410	Roselle	Hibiscus sabdariffa	Herbs and Spices
BXGF00806	Alcoholic beverages		Beverages
BXGF00808	Pomes		Fruits
BXGF00810	Cereals and cereal products		Cereals and cereal products
BXGF00811	Citrus		Fruits
BXGF00812	Cocoa and cocoa products		Cocoa and cocoa products
BXGF00815	Milk and milk products		Milk and milk products
BXGF00821	Nuts		Nuts
BXGF00823	Fruits		Fruits
BXGF00829	Green bell pepper	Capsicum annuum	Vegetables
BXGF00830	Yellow bell pepper	Capsicum annuum	Vegetables
BXGF00831	Orange bell pepper	Capsicum annuum	Vegetables
BXGF00832	Red bell pepper	Capsicum annuum	Vegetables
BXGF01065	Artemisia capillaris	Artemisia capillaris	Medicinal Plant
BXGF01140	Angelica gigas	Angelica gigas	Medicinal Plant
BXGF01637	Gynura segetum	Gynura segetum	Medicinal Plant
BXGF02049	Angelica sinensis	Angelica sinensis	Medicinal Plant
BXGF02268	Ginkgo semen	Ginkgo semen	Others
BXGF02330	Codonopsis pilosula	Codonopsis pilosula	Medicinal Plant
BXGF02567	Lycium chinense	Lycium chinense	Medicinal Plant
BXGF02754	Hyoscyamus niger	Hyoscyamus niger	Medicinal Plant
BXGF03234	Plantago major	Plantago major	Medicinal Plant
BXGF03249	Vitex trifolia	Vitex trifolia	Medicinal Plant
BXGF03319	Trichosanthes kirilowii	Trichosanthes kirilowii	Medicinal Plant
BXGF03527	Alpinia oxyphylla	Alpinia oxyphylla	Medicinal Plant
BXGF04053	Smilax china	Smilax china	Medicinal Plant
BXGF04758	Caragana sinica	Caragana sinica	Medicinal Plant
BXGF04842	Angelica acutiloba	Angelica acutiloba	Medicinal Plant
BXGF04915	Croton tiglium	Croton tiglium	Medicinal Plant
BXGF05011	Artemisia capillaries	Artemisia capillaries	Others
BXGF05041	Desmodium styracifolium	Desmodium styracifolium	Medicinal Plant
BXGF05322	Trichosanthes rosthornii	Trichosanthes rosthornii	Medicinal Plant
BXGF05571	Ziziphus jujuba	Ziziphus jujuba	Medicinal Plant
BXGF05962	Rehmannia glutinosa	Rehmannia glutinosa	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}