acompound

Showing entry for 5-Methoxy-N-Methyltryptamine

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0050611
Compound Name	5-Methoxy-N-Methyltryptamine
Structure
Formula	C12H16N2O
InchiKey	NFDDCRIHMZGWBP-UHFFFAOYSA-N
SMILES	CNCCc1c[nH]c2c1cc(OC)cc2
Inchi	InChI=1S/C12H16N2O/c1-13-6-5-9-8-14-12-4-3-10(15-2)7-11(9)12/h3-4,7-8,13-14H,5-6H2,1-2H3
IUPAC	2-(5-methoxy-1H-indol-3-yl)-N-methylethanamine
Molecular Weight	204.13
Pubchem Id	16184
Chembl Id	CHEMBL58579

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	BXGT009239	5-hydroxytryptamine receptor 2A	reviewed	G-protein coupled receptor	HTR2A	4.1	-	-	-
reviewed	BXGT009239	5-hydroxytryptamine receptor 2A	reviewed	G-protein coupled receptor	HTR2A	450	-	-	-
reviewed	BXGT006838	5-hydroxytryptamine receptor 2C	reviewed		Htr2c	840	-	-	-
reviewed	BXGT004559	Acetylcholinesterase	reviewed		ache	-	12500	-	-

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
P28223	BXGT009239	5-hydroxytryptamine receptor 2A	reviewed	G-protein coupled receptor	HTR2A	Ki	'='	4	nM
O42275	BXGT004559	Acetylcholinesterase	reviewed	-	ache	IC50	'='	12500	nM
P28223	BXGT009239	5-hydroxytryptamine receptor 2A	reviewed	G-protein coupled receptor	HTR2A	Ki	'='	450	nM
P08909	BXGT006838	5-hydroxytryptamine receptor 2C	reviewed	-	Htr2c	Ki	'='	840	nM
P28335	BXGT009255	5-hydroxytryptamine receptor 2C	reviewed	G-protein coupled receptor	HTR2C	Ratio	'='	205	-

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00073	Japanese persimmon	Diospyros kaki	Fruits
BXGF02702	Arundo donax	Arundo donax	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}