Drug Information

Drug General Information
Drug ID
DXAT2U
Drug Name
SID11111897
Synonyms
CHEMBL1234071
Indication Discovery agent Investigative [1587926]
Formula
C8H14O2S2
Canonical SMILES
OC(=O)CCCC[C@H]1CCSS1
InChI
InChI=1S/C8H14O2S2/c9-8(10)4-2-1-3-7-5-6-11-12-7/h7H,1-6H2,(H,9,10)/t7-/m0/s1
InChIKey
AGBQKNBQESQNJD-ZETCQYMHSA-N
Target and Pathway
Target(s) Acetylcholinesterase Target Info [1587926]
Prostaglandin G/H synthase 1 Target Info [1587926]
BioCyc Pathway C20 prostanoid biosynthesis
KEGG Pathway Glycerophospholipid metabolism
Cholinergic synapsehsa00590:Arachidonic acid metabolism
Metabolic pathways
Platelet activation
Serotonergic synapse
NetPath Pathway TGF_beta_Receptor Signaling Pathway
PANTHER Pathway Muscarinic acetylcholine receptor 1 and 3 signaling pathway
Muscarinic acetylcholine receptor 2 and 4 signaling pathway
Nicotinic acetylcholine receptor signaling pathwayP00031:Inflammation mediated by chemokine and cytokine signaling pathway
Pathway Interaction Database ATF-2 transcription factor network
PathWhiz Pathway Phospholipid BiosynthesisPW000044:Arachidonic Acid Metabolism
WikiPathways Monoamine Transport
Biogenic Amine Synthesis
Acetylcholine Synthesis
Integrated Pancreatic Cancer PathwayWP98:Prostaglandin Synthesis and Regulation
Arachidonic acid metabolism
Phase 1 - Functionalization of compounds
Eicosanoid Synthesis
Selenium Micronutrient Network
References
Ref 1587926URL: https://www.ebi.ac.uk/chembl/ The ChEMBL database in 2017
Ref 1587926URL: https://www.ebi.ac.uk/chembl/ The ChEMBL database in 2017

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