acompound

Showing entry for Dimethylcurcumin

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0037401
Compound Name	Dimethylcurcumin
Structure
Formula	C23H24O6
InchiKey	ZMGUKFHHNQMKJI-CIOHCNBKSA-N
SMILES	COc1cc(/C=C/C(=C/C(=O)/C=C/c2ccc(c(c2)OC)OC)/O)ccc1OC
Inchi	InChI=1S/C23H24O6/c1-26-20-11-7-16(13-22(20)28-3)5-9-18(24)15-19(25)10-6-17-8-12-21(27-2)23(14-17)29-4/h5-15,24H,1-4H3/b9-5+,10-6+,18-15-
IUPAC	(1E,4Z,6E)-1,7-bis(3,4-dimethoxyphenyl)-5-hydroxyhepta-1,4,6-trien-3-one
Molecular Weight	396.16
Pubchem Id	6477182
Chembl Id	CHEMBL128748

Targets of Information Source

DrugBank

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
P10275	BXGT007552	Androgen receptor	reviewed	Nuclear receptor	AR	investigational	inhibitor

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
Q7ZJM1	BXGT017268	Integrase	unreviewed	-	pol	IC50	'='	100000	nM
P21860	BXGT008698	Receptor tyrosine-protein kinase erbB-3	reviewed	Kinase	ERBB3	Inhibition	-	-	-
Q15303	BXGT013557	Receptor tyrosine-protein kinase erbB-4	reviewed	Kinase	ERBB4	Inhibition	-	-	-
P00533	BXGT005575	Epidermal growth factor receptor	reviewed	Kinase	EGFR	Inhibition	-	-	-
P04626	BXGT006238	Receptor tyrosine-protein kinase erbB-2	reviewed	Kinase	ERBB2	Inhibition	-	-	-
P10275	BXGT007552	Androgen receptor	reviewed	Nuclear receptor	AR	Reduction	'='	70	%
P05067	BXGT006306	Amyloid-beta precursor protein	reviewed	Enzyme modulator	APP	Inhibition	'='	0	%
Q7ZJM1	BXGT017268	Integrase	unreviewed	-	pol	IC50	'>'	100000	nM
P56817	BXGT011200	Beta-secretase 1	reviewed	Enzyme	BACE1	Inhibition	'='	0	%
P10275	BXGT007552	Androgen receptor	reviewed	Nuclear receptor	AR	Reduction	'='	45	%
P00533	BXGT005575	Epidermal growth factor receptor	reviewed	Kinase	EGFR	Inhibition	-	-	-

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF03733	Alpinia officinarum	Alpinia officinarum	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}