acompound

Showing entry for Isowighteone

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0012943
Compound Name	Isowighteone
Structure
Formula	C20H16O4
InchiKey	PWAACAMQKVIVPZ-UHFFFAOYSA-N
SMILES	Oc1ccc2c(c1)occ(c2=O)c1ccc2c(c1)C=CC(O2)(C)C
Inchi	InChI=1S/C20H16O4/c1-20(2)8-7-13-9-12(3-6-17(13)24-20)16-11-23-18-10-14(21)4-5-15(18)19(16)22/h3-11,21H,1-2H3
IUPAC	3-(2,2-dimethylchromen-6-yl)-7-hydroxychromen-4-one
Molecular Weight	320.1
Pubchem Id	5316097
Chembl Id	CHEMBL1271888

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
B4URF0	BXGT002146	Neuraminidase	unreviewed	-	NA	Ki	-	-	-
B4URF0	BXGT002146	Neuraminidase	unreviewed	-	NA	IC50	'>'	50	ug.mL-1
Q9BJJ9	BXGT020099	Enoyl-ACP reductase	unreviewed	-	FabI	Inhibition	'='	66	%
Q9BJJ9	BXGT020099	Enoyl-ACP reductase	unreviewed	-	FabI	IC50	'='	58950	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF04734	Cullen corylifolium	Cullen corylifolium	Medicinal Plant
BXGF04806	Ulex airensis	Ulex airensis	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}