Drug Information

Drug General Information
Drug ID
D05DSK
Former ID
DCL000282
Drug Name
E2101
Drug Type
Small molecular drug
Indication Cervical dystonia; Spasm [ICD9: 333.83, 728.85; ICD10:G24.3, R25.2] Discontinued in Phase 1 [547174]
Company
Eisai Co. Ltd.
Structure
Download
2D MOL

3D MOL
Formula
C24H28FN3O
Canonical SMILES
CNC(=O)CC1=CC2=C(C=C1)C=CN2C3CCN(CC3)CCC4=CC=CC=C4F
InChI
1S/C24H28FN3O/c1-26-24(29)17-18-6-7-20-9-15-28(23(20)16-18)21-10-13-27(14-11-21)12-8-19-4-2-3-5-22(19)25/h2-7,9,15-16,21H,8,10-14,17H2,1H3,(H,26,29)
InChIKey
CQEOXWCXSBFJMB-UHFFFAOYSA-N
PubChem Compound ID
9908587
PubChem Substance ID
14878713, 24189516, 45980250, 75049287, 85210212, 134338938, 140171203, 230041974, 243044310
Target and Pathway
Target(s) 5-hydroxytryptamine 1A receptor Target Info Modulator [535482]
KEGG Pathway cAMP signaling pathway
Neuroactive ligand-receptor interaction
Serotonergic synapse
PANTHER Pathway Heterotrimeric G-protein signaling pathway-Gi alpha and Gs alpha mediated pathway
5HT1 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 signaling
References
Ref 547174Trusted, scientifically sound profiles of drug programs, clinical trials, safety reports, and company deals, written by scientists. Springer. 2015. Adis Insight (drug id 800013610)
Ref 535482In vitro interactions between a potential muscle relaxant E2101 and human cytochromes P450. Drug Metab Dispos. 2002 Jul;30(7):805-13.

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