acompound

Showing entry for Demethoxymatteucinol

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0033021
Compound Name	Demethoxymatteucinol
Structure
Formula	C17H16O4
InchiKey	HAIHGFWQOPJMPV-ZDUSSCGKSA-N
SMILES	Cc1c2O[C@@H](CC(=O)c2c(c(c1O)C)O)c1ccccc1
Inchi	InChI=1S/C17H16O4/c1-9-15(19)10(2)17-14(16(9)20)12(18)8-13(21-17)11-6-4-3-5-7-11/h3-7,13,19-20H,8H2,1-2H3/t13-/m0/s1
IUPAC	(2S)-5,7-dihydroxy-6,8-dimethyl-2-phenyl-2,3-dihydrochromen-4-one
Molecular Weight	284.1
Pubchem Id	180550
Chembl Id	CHEMBL53439

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
P83916	BXGT012025	Chromobox protein homolog 1	reviewed	Epigenetic regulator	CBX1	Potency	-	89125	nM
Q9NUW8	BXGT021219	Tyrosyl-DNA phosphodiesterase 1	reviewed	Enzyme	TDP1	Potency	-	29092	nM
P35354	BXGT009816	Prostaglandin G/H synthase 2	reviewed	Enzyme	PTGS2	IC50	-	-	-
P23219	BXGT008837	Prostaglandin G/H synthase 1	reviewed	Enzyme	PTGS1	IC50	-	-	-
B4URF0	BXGT002146	Neuraminidase	unreviewed	-	NA	IC50	'='	319120	nM
Q9UNA4	BXGT021785	DNA polymerase iota	reviewed	-	POLI	Potency	-	79432	nM
B4URF0	BXGT002146	Neuraminidase	unreviewed	-	NA	Inhibition	-	-	-
Q99700	BXGT019949	Ataxin-2	reviewed	Nucleic acid binding	ATXN2	Potency	-	22387	nM
B4URF0	BXGT002146	Neuraminidase	unreviewed	-	NA	IC50	'='	333590	nM
Q03431	BXGT012714	Parathyroid hormone/parathyroid hormone-related peptide receptor	reviewed	G-protein coupled receptor	PTH1R	Potency	-	89125	nM
P03468	BXGT006079	Neuraminidase	reviewed	-	NA	IC50	'='	30300	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF01386	Asarum heterotropoides	Asarum heterotropoides	Others
BXGF01777	Centaurea aspera	Centaurea aspera	Others
BXGF02677	Pteris fauriei	Pteris fauriei	Medicinal Plant
BXGF02957	Crotalaria novae-hollandiae	Crotalaria novae-hollandiae	Others
BXGF03235	Syzygium samarangense	Syzygium samarangense	Medicinal Plant
BXGF03303	Psorothamnus polydenius	Psorothamnus polydenius	Others
BXGF03847	Thermopsis mollis	Thermopsis mollis	Others
BXGF04072	Hyptis brevipes	Hyptis brevipes	Medicinal Plant
BXGF04430	Crinum latifolium	Crinum latifolium	Medicinal Plant
BXGF05073	Alnus cordata	Alnus cordata	Human Edible Plant
BXGF05308	Aloe deltoideodonta	Aloe deltoideodonta	Others
BXGF05501	Bauhinia purpurea	Bauhinia purpurea	Medicinal Plant
BXGF05503	Garcinia livingstonei	Garcinia livingstonei	Medicinal Plant
BXGF05960	Leitneria floridana	Leitneria floridana	Others
BXGF06124	Notholaena aschenborniana	Notholaena aschenborniana	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}