Drug General Information
Drug ID
DX2JPI
Drug Name
(S)-1-(1H-Indol-4-yloxy)-3-[4-(4-isopropoxy-benzo[b]thiophen-2-yl)-piperidin-1-yl]-propan-2-ol
Synonyms
CHEMBL300763
Indication Discovery agent Investigative [1587926]
Formula
C27H32N2O3S
Canonical SMILES
CC(C)Oc1cccc2sc(cc12)C3CCN(C[C@H](O)COc4cccc5[nH]ccc45)CC3
InChI
InChI=1S/C27H32N2O3S/c1-18(2)32-25-7-4-8-26-22(25)15-27(33-26)19-10-13-29(14-11-19)16-20(30)17-31-24-6-3-5-23-21(24)9-12-28-23/h3-9,12,15,18-20,28,30H,10-11,13-14,16-17H2,1-2H3/t20-/m0/s1
InChIKey
PTGHMEHPYBQBFD-FQEVSTJZSA-N
Target and Pathway
Target(s) 5-hydroxytryptamine 1A receptor Target Info [1587926]
Sodium-dependent serotonin transporter Target Info [1587926]
KEGG Pathway cAMP signaling pathway
Neuroactive ligand-receptor interaction
Serotonergic synapsehsa04726:Serotonergic synapse
NetPath Pathway TCR Signaling Pathway
PANTHER Pathway Heterotrimeric G-protein signaling pathway-Gi alpha and Gs alpha mediated pathway
5HT1 type receptor mediated signaling pathwayP04373:5HT1 type receptor mediated signaling pathway
5HT2 type receptor mediated signaling pathway
5HT3 type receptor mediated signaling pathway
5HT4 type receptor mediated signaling pathway
Reactome Serotonin receptors
G alpha (i) signalling events
WikiPathways Serotonin HTR1 Group and FOS Pathway
SIDS Susceptibility Pathways
Monoamine GPCRs
GPCRs, Class A Rhodopsin-like
GPCR ligand binding
GPCR downstream signalingWP727:Monoamine Transport
NRF2 pathway
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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