acompound

Showing entry for Phenylpyruvate

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0053349
Compound Name	Phenylpyruvate
Structure
Formula	C9H8O3
InchiKey	BTNMPGBKDVTSJY-UHFFFAOYSA-N
SMILES	O=C(C(=O)O)Cc1ccccc1
Inchi	InChI=1S/C9H8O3/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,11,12)
IUPAC	2-oxo-3-phenylpropanoic acid
Molecular Weight	164.05
Pubchem Id	997
Chembl Id	CHEMBL1162488

Targets of Information Source

DrugBank

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
Q59771	BXGT015265	Phenylalanine dehydrogenase	reviewed	-	pdh	experimental	-
Q9UJM8	BXGT021726	Hydroxyacid oxidase 1	reviewed	-	HAO1	experimental	-
P51852	BXGT010898	Indole-3-pyruvate decarboxylase	reviewed	-	ipdC	experimental	-
Q7NSZ5	BXGT017061	Uncharacterized protein	unreviewed	-	CV_3270	experimental	-
P39639	BXGT010126	H2HPP isomerase	reviewed	-	bacB	experimental	-
A1A2B5	BXGT000980	Probable chorismate mutase	unreviewed	-	pheA	experimental	-

PDB

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
Q59771	BXGT015265	Phenylalanine dehydrogenase	reviewed	pdh	-	-	-	-	-
P00175	BXGT005478	Cytochrome b2, mitochondrial	reviewed	CYB2	-	-	-	-	-
P51852	BXGT010898	Indole-3-pyruvate decarboxylase	reviewed	ipdC	-	-	-	-	-
Q7NSZ5	BXGT017061	Uncharacterized protein	unreviewed	CV_3270	-	-	-	-	-
P39639	BXGT010126	H2HPP isomerase	reviewed	bacB	-	-	-	-	-
A1A2B5	BXGT000980	Probable chorismate mutase	unreviewed	pheA	-	-	-	-	-
Q2IR47	BXGT014102	Extracellular ligand-binding receptor	unreviewed	RPB_4630	-	-	-	-	-
Q643C8	BXGT016118	Phenylpyruvate C(3)-methyltransferase	reviewed	mppJ	-	-	-	-	-
Q13363	BXGT013344	C-terminal-binding protein 1	reviewed	CTBP1	Transcription factor	-	-	-	-
O52792	BXGT023675	4-hydroxymandelate oxidase	reviewed	hmo	-	-	-	-	-
A0A1D8PMC5	BXGT024202	Aromatic-amino-acid:2-oxoglutarate transaminase	unreviewed	ARO9	-	-	-	-	-

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

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
Q80UJ1	BXGT017282	Solute carrier family 22 member 20	reviewed	-	Slc22a20	Ki	'='	29000	nM
O15427	BXGT004167	Monocarboxylate transporter 4	reviewed	Transporter	SLC16A3	Activity	-	-	-
Q8VC69	BXGT018912	Solute carrier family 22 member 6	reviewed	-	Slc22a6	Ki	'='	79000	nM
Q80UJ1	BXGT017282	Solute carrier family 22 member 20	reviewed	-	Slc22a20	Ki	'='	28840	nM
P68400	BXGT011599	Casein kinase II subunit alpha	reviewed	Kinase	CSNK2A1	Delta Tm	'='	0	degrees C
Q8VC69	BXGT018912	Solute carrier family 22 member 6	reviewed	-	Slc22a6	Ki	'='	79432	nM
P56545	BXGT011178	C-terminal-binding protein 2	reviewed	Transcription factor	CTBP2	IC50	'='	116300	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF01185	Aloe vera	Aloe vera	Medicinal Plant
BXGF01900	Aloe ferox	Aloe ferox	Medicinal Plant
BXGF04631	Aloe spicata	Aloe spicata	Medicinal Plant
BXGF04926	Aloe africana	Aloe africana	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}