acompound

Showing entry for Isocitric acid

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0002431
Compound Name	Isocitric acid
Structure
Formula	C6H8O7
InchiKey	ODBLHEXUDAPZAU-UHFFFAOYSA-N
SMILES	OC(C(CC(O)=O)C(O)=O)C(O)=O
Inchi	InChI=1S/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13)
IUPAC	1-hydroxypropane-1,2,3-tricarboxylic acid
Molecular Weight	192.12
Pubchem Id	1198
Chembl Id	CHEMBL539669

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

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	BXGT022418	Methyl-accepting chemotaxis protein NahY	reviewed		nahY	-	-	337000	-

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
Q9GZT9	BXGT020425	Egl nine homolog 1	reviewed	-	EGLN1	IC50	'>'	10000000	nM
Q9GZT9	BXGT020425	Egl nine homolog 1	reviewed	-	EGLN1	Inhibition	-	-	-
P00808	BXGT005665	Beta-lactamase	reviewed	-	penP	Ki	'='	2200000	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00015	Wild celery	Apium graveolens	Herbs and Spices
BXGF00072	Wild carrot	Daucus carota	Vegetables
BXGF00105	Apple	Malus pumila	Fruits
BXGF00156	Redcurrant	Ribes rubrum	Fruits
BXGF00157	Gooseberry	Ribes uva-crispa	Fruits
BXGF00230	Carrot	Daucus carota ssp. sativus	Vegetables
BXGF00440	Soursop	Annona muricata	Fruits
BXGF05203	Chlamydomonas reinhardtii	Chlamydomonas reinhardtii	Others

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}