acompound

Showing entry for Arborinine

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0001420
Compound Name	Arborinine
Structure
Formula	C16H15NO4
InchiKey	ATBZZQPALSPNMF-UHFFFAOYSA-N
SMILES	COC1=C(OC)C(O)=C2C(=O)C3=CC=CC=C3N(C)C2=C1
Inchi	InChI=1S/C16H15NO4/c1-17-10-7-5-4-6-9(10)14(18)13-11(17)8-12(20-2)16(21-3)15(13)19/h4-8,19H,1-3H3
IUPAC	1-hydroxy-2,3-dimethoxy-10-methyl-9,10-dihydroacridin-9-one
Molecular Weight	285.29
Pubchem Id	5281832
Chembl Id	CHEMBL349609

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	BXGT009016	Adenosine receptor A1	reviewed		Adora1	12700	-	-	-
reviewed	BXGT009437	Adenosine receptor A2a	reviewed		Adora2a	6470	-	-	-

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
P30543	BXGT009437	Adenosine receptor A2a	reviewed	-	Adora2a	Ki	'='	6470	nM
P0DMS8	BXGT007506	Adenosine receptor A3	reviewed	G-protein coupled receptor	ADORA3	Displacement	'='	63	%
P25099	BXGT009016	Adenosine receptor A1	reviewed	-	Adora1	Ki	'='	12700	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00729	Shea tree	Vitellaria paradoxa	Herbs and Spices
BXGF00818	Herbs and Spices		Herbs and Spices
BXGF04198	Strychnos potatorum	Strychnos potatorum	Medicinal Plant
BXGF04262	Daphne tangutica	Daphne tangutica	Others
BXGF05165	Ruta graveolens	Ruta graveolens	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}