acompound

Showing entry for n.a

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0021684
Compound Name	n.a
Structure
Formula	C18H16O5
InchiKey	HICKZJMJOXACIR-UHFFFAOYSA-N
SMILES	COc1cc(OC)c2c(c1)C(=O)c1c(C2=O)c(OC)cc(c1)C
Inchi	InChI=1S/C18H16O5/c1-9-5-11-15(13(6-9)22-3)18(20)16-12(17(11)19)7-10(21-2)8-14(16)23-4/h5-8H,1-4H3
IUPAC	1,3,8-trimethoxy-6-methylanthracene-9,10-dione
Molecular Weight	312.1
Pubchem Id	7330510
Chembl Id	CHEMBL428867

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
P08419	BXGT006770	Chymotrypsin-like elastase family member 2A	reviewed	-	CELA2A	Inhibition	'='	4	%
P08246	BXGT006756	Neutrophil elastase	reviewed	Enzyme	ELANE	Inhibition	'='	16	%
P00766	BXGT005647	Chymotrypsinogen A	reviewed	-		Inhibition	'='	6	%
P08311	BXGT006762	Cathepsin G	reviewed	Enzyme	CTSG	Inhibition	-	-	-
P03372	BXGT006059	Estrogen receptor	reviewed	Nuclear receptor	ESR1	Control	'='	109	%
Q92731	BXGT019366	Estrogen receptor beta	reviewed	Nuclear receptor	ESR2	Control	'='	109	%
P03372	BXGT006059	Estrogen receptor	reviewed	Nuclear receptor	ESR1	Control	'<'	127	%
Q92731	BXGT019366	Estrogen receptor beta	reviewed	Nuclear receptor	ESR2	Control	'<'	127	%
P03372	BXGT006059	Estrogen receptor	reviewed	Nuclear receptor	ESR1	Control	'='	99	%
Q92731	BXGT019366	Estrogen receptor beta	reviewed	Nuclear receptor	ESR2	Control	'='	99	%

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF01126	Polygonum cuspidatum	Polygonum cuspidatum	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}