acompound

Showing entry for 1,2-Benzoxazol-3-One

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0035234
Compound Name	1,2-Benzoxazol-3-One
Structure
Formula	C7H5NO2
InchiKey	QLDQYRDCPNBPII-UHFFFAOYSA-N
SMILES	Oc1noc2c1cccc2
Inchi	InChI=1S/C7H5NO2/c9-7-5-3-1-2-4-6(5)10-8-7/h1-4H,(H,8,9)
IUPAC	1,2-benzoxazol-3-one
Molecular Weight	135.03
Pubchem Id	210830
Chembl Id	CHEMBL444173

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

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
O43175	BXGT004575	D-3-phosphoglycerate dehydrogenase	reviewed	PHGDH	Enzyme	-	-	6500000	-

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	BXGT005519	D-amino-acid oxidase	reviewed		DAO	-	1880	-	-

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
O43175	BXGT004575	D-3-phosphoglycerate dehydrogenase	reviewed	Enzyme	PHGDH	Kd	'='	6500000	nM
P00371	BXGT005519	D-amino-acid oxidase	reviewed	-	DAO	IC50	'='	1880	nM
O43175	BXGT004575	D-3-phosphoglycerate dehydrogenase	reviewed	Enzyme	PHGDH	Delta Tm	'='	2	degrees C
P14920	BXGT008067	D-amino-acid oxidase	reviewed	-	DAO	IC50	'='	418	nM
P00371	BXGT005519	D-amino-acid oxidase	reviewed	-	DAO	Kd	'='	440	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00090	Star anise	Illicium verum	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}