Drug Information

Drug General Information
Drug ID
D0E8FG
Former ID
DNC012296
Drug Name
1-(1-Benzo[b]thiophen-2-yl-cycloheptyl)-azepane
Drug Type
Small molecular drug
Indication Discovery agent Investigative [533891]
Structure
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2D MOL

3D MOL
Formula
C21H29NS
Canonical SMILES
C1CCCC(CC1)(C2=CC3=CC=CC=C3S2)N4CCCCCC4
InChI
1S/C21H29NS/c1-2-8-14-21(13-7-1,22-15-9-3-4-10-16-22)20-17-18-11-5-6-12-19(18)23-20/h5-6,11-12,17H,1-4,7-10,13-16H2
InChIKey
SHYAOKYYAHMSCY-UHFFFAOYSA-N
PubChem Compound ID
14952700
Target and Pathway
Target(s) Sodium-dependent dopamine transporter Target Info Inhibitor [533891]
KEGG Pathway Dopaminergic synapse
Parkinson's disease
Cocaine addiction
Amphetamine addiction
Alcoholism
PANTHER Pathway Adrenaline and noradrenaline biosynthesis
Parkinson disease
Dopamine receptor mediated signaling pathway
Pathway Interaction Database Alpha-synuclein signaling
Reactome Na+/Cl- dependent neurotransmitter transporters
WikiPathways Monoamine Transport
NRF2 pathway
Dopaminergic Neurogenesis
Parkinsons Disease Pathway
Transport of glucose and other sugars, bile salts and organic acids, metal ions and amine compounds
Neurotransmitter Clearance In The Synaptic Cleft
References
Ref 533891J Med Chem. 1993 Apr 30;36(9):1188-93.Synthesis and biological evaluation of 1-[1-(2-benzo[b]thienyl)cyclohexyl]piperidine homologues at dopamine-uptake and phencyclidine- and sigma-binding sites.
Ref 533891J Med Chem. 1993 Apr 30;36(9):1188-93.Synthesis and biological evaluation of 1-[1-(2-benzo[b]thienyl)cyclohexyl]piperidine homologues at dopamine-uptake and phencyclidine- and sigma-binding sites.

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