acompound

General Compound Information
BXGC Id	BXGC0001091
Compound Name	Allantoin
Structure
Formula	C4H6N4O3
InchiKey	POJWUDADGALRAB-UHFFFAOYSA-N
SMILES	NC(=O)NC1NC(=O)NC1=O
Inchi	InChI=1S/C4H6N4O3/c5-3(10)6-1-2(9)8-4(11)7-1/h1H,(H3,5,6,10)(H2,7,8,9,11)
IUPAC	(2,5-dioxoimidazolidin-4-yl)urea
Molecular Weight	158.12
Pubchem Id	204
Chembl Id	CHEMBL593429

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

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
O14924	BXGT004111	Regulator of G-protein signaling 12	reviewed	-	RGS12	Potency	'='	12589	nM
Q9Y6L6	BXGT022334	Solute carrier organic anion transporter family member 1B1	reviewed	Transporter	SLCO1B1	Inhibition	'='	67	%
P37840	BXGT010015	Alpha-synuclein	reviewed	Transporter	SNCA	Potency	-	5623	nM
Q9NPD5	BXGT021151	Solute carrier organic anion transporter family member 1B3	reviewed	Transporter	SLCO1B3	Inhibition	'='	86	%
P11473	BXGT007709	Vitamin D3 receptor	reviewed	Nuclear receptor	VDR	Potency	-	89125	nM
P27695	BXGT009199	DNA-(apurinic or apyrimidinic site) lyase	reviewed	-	APEX1	Potency	-	7079	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00026	Borage	Borago officinalis	Herbs and Spices
BXGF00038	Tea	Camellia sinensis	Teas
BXGF00052	Watermelon	Citrullus lanatus	Gourds
BXGF00059	Arabica coffee	Coffea arabica	Coffee and coffee products
BXGF00085	Soy bean	Glycine max	Soy
BXGF00125	Rice	Oryza sativa	Cereals and cereal products
BXGF00141	Common pea	Pisum sativum	Pulses
BXGF00142	Purslane	Portulaca oleracea	Herbs and Spices
BXGF00146	Sour cherry	Prunus cerasus	Fruits
BXGF00175	Potato	Solanum tuberosum	Vegetables
BXGF00187	Common wheat	Triticum aestivum	Cereals and cereal products
BXGF00199	Gram bean	Vigna mungo	Pulses
BXGF00205	Corn	Zea mays	Cereals and cereal products
BXGF00246	Red beetroot	Beta vulgaris var. rubra	Vegetables
BXGF00370	White lupine	Lupinus albus	Pulses
BXGF00729	Shea tree	Vitellaria paradoxa	Herbs and Spices
BXGF01045	Dioscorea japonica	Dioscorea japonica	Medicinal Plant
BXGF01771	Achyranthes fauriei	Achyranthes fauriei	Medicinal Plant
BXGF01907	Aristolochia contorta	Aristolochia contorta	Medicinal Plant
BXGF01960	Achyranthes bidentata	Achyranthes bidentata	Medicinal Plant
BXGF03608	Achyranthes japonica	Achyranthes japonica	Medicinal Plant
BXGF03898	Dioscorea polystachya	Dioscorea polystachya	Medicinal Plant
BXGF03913	Aristolochia debilis	Aristolochia debilis	Medicinal Plant
BXGF04943	Pueraria lobata	Pueraria lobata	Medicinal Plant
BXGF05919	Dioscorea opposita	Dioscorea opposita	Human Edible Plant
BXGF06079	Pueraria montana var. lobata	Pueraria montana var. lobata	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}