Chemical, Structural, Clinical and Biological details of Antiviral agents ID: DrugRepV_0335



Chemical Information
Antiviral agent IDDrugRepV_0335
Antiviral agent nameParoxetine Drug Bank
IUPAC Name(3S,4R)-3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)piperidine PubChem
SMILES (canonical)C1CNCC(C1C2=CC=C(C=C2)F)COC3=CC4=C(C=C3)OCO4 PubChem
SMILES (isomeric)C1CNC[C@H]([C@@H]1C2=CC=C(C=C2)F)COC3=CC4=C(C=C3)OCO4 PubChem
Molecular FormulaC19H20FNO3 PubChem
Molecular Weight (g/mol)329.37 PubChem
InChlInChI=1S/C19H20FNO3/c20-15-3-1-13(2-4-15)17-7-8-21-10-14(17)11-22-16-5-6-18-19(9-16)24-12-23-18/h1-6,9,14,17,21H,7-8,10-12H2/t14-,17-/m0/s1 PubChem
Common NameParoxetine Drug Bank
Synonyms(−)-(3S,4R)-4-(p-fluorophenyl)-3-((3,4-(methylenedioxy)phenoxy)methyl)piperidine | (3S-trans)-3-((1,3-benzodioxol-5-yloxy)methyl)-4-(4-fluorophenyl)piperidine | Paroxetina | Paroxetinum
Structural Information
  
Clinical Information
CategoryNervous System
Primary Indication (Clinical trial phases)Approved, Investigational Drug Bank
Biological Information
Primary Indication (Disease Category) Non Infectious Disease
Primary Indication (Disease)Major depressive disorder (MDD) | Panic disorder | Obsessive-compulsive disorder (OCD) | Social anxiety disorder (social phobia) | Generalized anxiety disorder (GAD) | Post-traumatic stress disorder (PTSD) | Premenstrual dysphoric disorder (PMDD)
Secondary Indication Ebola virus (EBOV) NA EBOV-eGFPWorld Health OrganisationCDC
Secondary Indication (Approaches)Experimental
Secondary Indication (Methods)In-vitro
Secondary Indication (Model system) [cell lines/ animal models]Vero76
Secondary Indication (Mode of viral infection)Adsorption
Secondary Indication (Viral titer)1.0:5.0 MOI
Secondary Indication (Mode of drug delivery) Culture
Secondary Indication (Time of drug delivery) Pre infection (1 hour)
Secondary Indication (Duration of drug delivery)48 hours
Secondary Indication (Drug concentration)27 μM
Secondary Indication (Cell based assay)Immunoflourescence assay
Secondary Indication (Change)Decrease
Secondary Indication (Type of Inhibition) EC50 [ 50 % ]
Secondary Indication (Cytotoxicity)>50 μM
ReferenceMadrid PB, Panchal RG, Warren TK, Shurtleff AC, Endsley AN, Green CE, Kolokoltsov A, Davey R, Manger.Evaluation of Ebola Virus Inhibitors for Drug Repurposing..ACS Infect Dis. 2015 Jul 10;1(7):317-26. doi: 10.1021/acsinfecdis.5b00030. Epub 2015 May 11. PMID:27622822 PubMed
CommentEBOV replication EC50 values. The results have identified a set of antimalarials as candidates for the treatment or prophylaxis of EBOV infection, as well as potentially an anthelmintic and antibiotic. The ability to repurpose these drugs for EBOV infection will depend on their efficacy in additional animal models with optimized dosing regimens for the new indication.