Drug Information

Drug General Information
Drug ID
DXS6YU
Drug Name
3-[4-(4-chlorophenyl)-1-methyl-(3R,4S)-hexahydro-3-pyridinylcarbonyloxy]propyl 4-(4-chlorophenyl)-1-methyl-(3R,4S)-hexahydro-3-pyridinecarboxylate
Synonyms
CHEMBL44070
Indication Discovery agent Investigative [1587926]
Formula
C29H36Cl2N2O4
Canonical SMILES
CN1CC[C@@H]([C@H](C1)C(=O)OCCCOC(=O)[C@H]2CN(C)CC[C@@H]2c3ccc(Cl)cc3)c4ccc(Cl)cc4
InChI
InChI=1S/C29H36Cl2N2O4/c1-32-14-12-24(20-4-8-22(30)9-5-20)26(18-32)28(34)36-16-3-17-37-29(35)27-19-33(2)15-13-25(27)21-6-10-23(31)11-7-21/h4-11,24-27H,3,12-19H2,1-2H3/t24-,25-,26+,27+/m1/s1
InChIKey
BFHQGCXVEJLAPS-XDZXDJIYSA-N
Target and Pathway
Target(s) Sodium-dependent noradrenaline transporter Target Info [1587926]
Sodium-dependent serotonin transporter Target Info [1587926]
KEGG Pathway Serotonergic synapse
NetPath Pathway TCR Signaling Pathway
PANTHER Pathway Adrenaline and noradrenaline biosynthesisP04373:5HT1 type receptor mediated signaling pathway
5HT2 type receptor mediated signaling pathway
5HT3 type receptor mediated signaling pathway
5HT4 type receptor mediated signaling pathway
Reactome Na+/Cl- dependent neurotransmitter transporters
WikiPathways Monoamine Transport
NRF2 pathway
Transport of glucose and other sugars, bile salts and organic acids, metal ions and amine compoundsWP727:Monoamine Transport
SIDS Susceptibility Pathways
Synaptic Vesicle Pathway
Serotonin Transporter Activity
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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