acompound

Showing entry for Sid470675

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0045808
Compound Name	Sid470675
Structure
Formula	C17H18O4
InchiKey	UQIWTPQGJCCTPA-SNAWJCMRSA-N
SMILES	COc1cc(/C=C/c2ccc(c(c2)O)OC)cc(c1)OC
Inchi	InChI=1S/C17H18O4/c1-19-14-8-13(9-15(11-14)20-2)5-4-12-6-7-17(21-3)16(18)10-12/h4-11,18H,1-3H3/b5-4+
IUPAC	5-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]-2-methoxyphenol
Molecular Weight	286.12
Pubchem Id	5385086
Chembl Id	CHEMBL419378

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	BXGT008187	Ribosyldihydronicotinamide dehydrogenase [quinone]	reviewed		NQO2	-	15000	-	-
reviewed	BXGT008139	NAD(P)H dehydrogenase [quinone] 1	reviewed		NQO1	-	80000	-	-

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
P16083	BXGT008187	Ribosyldihydronicotinamide dehydrogenase [quinone]	reviewed	-	NQO2	IC50	'='	15000	nM
P15559	BXGT008139	NAD(P)H dehydrogenase [quinone] 1	reviewed	-	NQO1	IC50	'='	80000	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF06095	Rheum undulatum	Rheum undulatum	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}