acompound

Showing entry for Pyridoxal

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0047242
Compound Name	Pyridoxal
Structure
Formula	C8H9NO3
InchiKey	RADKZDMFGJYCBB-UHFFFAOYSA-N
SMILES	O=Cc1c(CO)cnc(c1O)C
Inchi	InChI=1S/C8H9NO3/c1-5-8(12)7(4-11)6(3-10)2-9-5/h2,4,10,12H,3H2,1H3
IUPAC	3-hydroxy-5-(hydroxymethyl)-2-methylpyridine-4-carbaldehyde
Molecular Weight	167.06
Pubchem Id	1050
Chembl Id	CHEMBL102970

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
O00764	BXGT003948	Pyridoxal kinase	reviewed	Kinase	PDXK	experimental; nutraceutical	-

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
P77150	BXGT011796	Pyridoxal kinase PdxY	reviewed	pdxY	-	-	-	-	-
P40191	BXGT010165	Pyridoxine/pyridoxal/pyridoxamine kinase	reviewed	pdxK	-	-	-	-	-
Q988B8	BXGT019886	Pyridoxamine--pyruvate transaminase	reviewed	ppaT	-	-	-	-	-
O00764	BXGT003948	Pyridoxal kinase	reviewed	PDXK	Kinase	-	-	-	-
Q89ZB9	BXGT017756	Pyridoxal kinase	unreviewed	BT_4458	-	-	-	-	-
A0A0H3JTP0	BXGT000427	Phosphomethylpyrimidine kinase	unreviewed	SAV0580	-	-	-	-	-
C6KT01	BXGT025604	Pyridoxal kinase	unreviewed	PF3D7_0616000	-	-	-	-	-

Binding DB

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	BXGT012869	Aldehyde oxidase	reviewed	Enzyme	AOX1	30000	-	-	-

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
Q92830	BXGT019379	Histone acetyltransferase KAT2A	reviewed	-	KAT2A	Potency	-	31622	nM
P15428	BXGT008121	15-hydroxyprostaglandin dehydrogenase [NAD(+)]	reviewed	-	HPGD	Potency	'='	14125	nM
B2RXH2	BXGT002006	Lysine-specific demethylase 4E	reviewed	-	KDM4E	Potency	'='	31622	nM
P02545	BXGT005889	Prelamin-A/C	reviewed	-	LMNA	Potency	'='	31622	nM
Q03164	BXGT012700	Histone-lysine N-methyltransferase 2A	reviewed	-	KMT2A	Potency	'='	39810	nM
O00255	BXGT003903	Menin	reviewed	-	MEN1	Potency	'='	39810	nM
P00352	BXGT005510	Retinal dehydrogenase 1	reviewed	Enzyme	ALDH1A1	Potency	'='	31622	nM
Q96KQ7	BXGT019687	Histone-lysine N-methyltransferase EHMT2	reviewed	Epigenetic regulator	EHMT2	Potency	-	19952	nM
Q9F4F7	BXGT020344	4'-phosphopantetheinyl transferase ffp	reviewed	-	ffp	Potency	'='	79432	nM
O00764	BXGT003948	Pyridoxal kinase	reviewed	Kinase	PDXK	Km	'='	59000	nM
Q9UBT6	BXGT021664	DNA polymerase kappa	reviewed	-	POLK	Potency	-	23778	nM
P27695	BXGT009199	DNA-(apurinic or apyrimidinic site) lyase	reviewed	-	APEX1	Potency	-	89125	nM
O75496	BXGT005132	Geminin	reviewed	-	GMNN	Potency	-	13335	nM
Q06278	BXGT012869	Aldehyde oxidase	reviewed	Enzyme	AOX1	Ki	'='	30000	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00008	Garlic	Allium sativum	Herbs and Spices

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}