acompound

Showing entry for Homocystine

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0015915
Compound Name	Homocystine
Structure
Formula	C8H16N2O4S2
InchiKey	ZTVZLYBCZNMWCF-UHFFFAOYSA-N
SMILES	NC(C(=O)O)CCSSCCC(C(=O)O)N
Inchi	InChI=1S/C8H16N2O4S2/c9-5(7(11)12)1-3-15-16-4-2-6(10)8(13)14/h5-6H,1-4,9-10H2,(H,11,12)(H,13,14)
IUPAC	2-azaniumyl-4-[(3-azaniumyl-3-carboxylatopropyl)disulfanyl]butanoate
Molecular Weight	268.06
Pubchem Id	10010
Chembl Id	CHEMBL212056

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
Q93088	BXGT019458	Betaine--homocysteine S-methyltransferase 1	reviewed	-	BHMT	IC50	-	-	-
Q93088	BXGT019458	Betaine--homocysteine S-methyltransferase 1	reviewed	-	BHMT	Inhibition	-	-	-
Q93088	BXGT019458	Betaine--homocysteine S-methyltransferase 1	reviewed	-	BHMT	Inhibition	'='	0	%

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00178	Spinach	Spinacia oleracea	Vegetables

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}