acompound

Showing entry for Thymine

General Compound Information
BXGC Id	BXGC0021016
Compound Name	Thymine
Structure
Formula	C5H6N2O2
InchiKey	RWQNBRDOKXIBIV-UHFFFAOYSA-N
SMILES	Oc1ncc(c(n1)O)C
Inchi	InChI=1S/C5H6N2O2/c1-3-2-6-5(9)7-4(3)8/h2H,1H3,(H2,6,7,8,9)
IUPAC	5-methyl-1H-pyrimidine-2,4-dione
Molecular Weight	126.04
Pubchem Id	1135
Chembl Id	CHEMBL993

Targets of Information Source

DrugBank

DB03462

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
P61497	BXGT011374	Deoxyribodipyrimidine photo-lyase	reviewed	-	phr	experimental	-
P07650	BXGT006654	Thymidine phosphorylase	reviewed	-	deoA	experimental	-

PDB

TDR

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
P61497	BXGT011374	Deoxyribodipyrimidine photo-lyase	reviewed	phr	-	-	-	-	-
P07650	BXGT006654	Thymidine phosphorylase	reviewed	deoA	-	-	-	-	-
P0A1F6	BXGT006985	Uridine phosphorylase	reviewed	udp	-	-	-	-	-
P19971	BXGT008537	Thymidine phosphorylase	reviewed	TYMP	Enzyme	-	-	-	-
Q6TFC6	BXGT016542	QdtC	unreviewed	qdtC	-	-	-	-	-
Q8K4Z3	BXGT018403	NAD(P)H-hydrate epimerase	reviewed	Naxe	-	-	-	-	-
Q5SFD1	BXGT015660	dTDP-4-dehydro-6-deoxyglucose 3-epimerase	reviewed	chmJ	-	-	-	-	-
Q12KT8	BXGT013294	WxcM-like protein	unreviewed	Sden_2659	-	-	-	-	-
Q6TFC5	BXGT016541	QdtA	unreviewed	qdtA	-	-	-	-	-
Q9KT71	BXGT020996	Uridine phosphorylase	unreviewed	VC_1034	-	-	-	-	-
Q6PL18	BXGT016479	ATPase family AAA domain-containing protein 2	reviewed	ATAD2	Epigenetic regulator	-	-	-	-
G4VGI0	BXGT003512	Putative uridine phosphorylase	reviewed	UPPA	-	-	-	-	-
Q7RYZ9	BXGT017092	Thymine dioxygenase	unreviewed	NCU06416	-	-	-	32000	-
A0A410UCT3	BXGT024581	Uridine phosphorylase	unreviewed	up	-	-	-	-	-

Binding DB

50134397

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	BXGT019995	Thymidine phosphorylase	reviewed		Tymp	347000000	-	-	-

CHEMBL

CHEMBL993

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
Q99N42	BXGT019995	Thymidine phosphorylase	reviewed	-	Tymp	Ki	'='	347000000	nM
Q6PL18	BXGT016479	ATPase family AAA domain-containing protein 2	reviewed	Epigenetic regulator	ATAD2	Kd	'='	10000000	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00042	Safflower	Carthamus tinctorius	Herbs and Spices
BXGF00063	Saffron	Crocus sativus	Herbs and Spices
BXGF00212	Chinese chives	Allium tuberosum	Herbs and Spices
BXGF00337	Ginkgo nuts	Ginkgo biloba	Herbs and Spices
BXGF00522	Narrowleaf cattail	Typha angustifolia	Vegetables
BXGF00872	Equisetum hyemale	Equisetum hyemale	Medicinal Plant
BXGF01185	Aloe vera	Aloe vera	Medicinal Plant
BXGF01323	Pinellia pedatisecta	Pinellia pedatisecta	Medicinal Plant
BXGF01347	Fritillaria delavayi	Fritillaria delavayi	Medicinal Plant
BXGF01413	Fritillaria verticillata	Fritillaria verticillata	Medicinal Plant
BXGF01479	Fritillaria cirrhosa	Fritillaria cirrhosa	Medicinal Plant
BXGF01776	Fritillaria prezewalskii	Fritillaria prezewalskii	Others
BXGF01900	Aloe ferox	Aloe ferox	Medicinal Plant
BXGF01913	Fritillaria unibracteata	Fritillaria unibracteata	Medicinal Plant
BXGF01973	Lonicera japonica	Lonicera japonica	Medicinal Plant
BXGF03439	Fritillaria przewalskii	Fritillaria przewalskii	Medicinal Plant
BXGF03444	Gastrodia elata	Gastrodia elata	Medicinal Plant
BXGF03811	Euryale ferox	Euryale ferox	Medicinal Plant
BXGF03919	Xanthium strumarium	Xanthium strumarium	Medicinal Plant
BXGF04103	Fritillaria taipaiensis	Fritillaria taipaiensis	Others
BXGF04600	Typha orientalis	Typha orientalis	Medicinal Plant
BXGF04631	Aloe spicata	Aloe spicata	Medicinal Plant
BXGF04926	Aloe africana	Aloe africana	Medicinal Plant
BXGF04963	Equisetum hiemale	Equisetum hiemale	Medicinal Plant
BXGF05330	Arum ternatum thunb	Arum ternatum thunb	Others
BXGF05433	Liriope muscari	Liriope muscari	Medicinal Plant
BXGF05571	Ziziphus jujuba	Ziziphus jujuba	Medicinal Plant
BXGF06185	Ophiopogon japonicus	Ophiopogon japonicus	Medicinal Plant
BXGF06311	Crinum asiaticum	Crinum asiaticum	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}