Chemical, Structural, Clinical and Biological details of Antiviral agents ID: DrugRepV_1979



Chemical Information
Antiviral agent IDDrugRepV_1979
Antiviral agent nameBenztropine Mesylate Drug Bank
IUPAC Name(1R,5S)-3-benzhydryloxy-8-methyl-8-azabicyclo[3.2.1]octane;methanesulfonic acid PubChem
SMILES (canonical)CN1C2CCC1CC(C2)OC(C3=CC=CC=C3)C4=CC=CC=C4.CS(=O)(=O)O PubChem
SMILES (isomeric)CN1[C@@H]2CC[C@H]1CC(C2)OC(C3=CC=CC=C3)C4=CC=CC=C4.CS(=O)(=O)O PubChem
Molecular FormulaC22H29NO4S PubChem
Molecular Weight (g/mol)403.537 PubChem
InChlInChI=1S/C21H25NO.CH4O3S/c1-22-18-12-13-19(22)15-20(14-18)23-21(16-8-4-2-5-9-16)17-10-6-3-7-11-17;1-5(2,3)4/h2-11,18-21H,12-15H2,1H3;1H3,(H,2,3,4)/t18-,19+,20?; PubChem
Common NameCogentin Drug Bank
SynonymsCogentin | Benztropine mesilate | Benzatropine mesylate | Benztropine methylsulfonate
Structural Information
  
Clinical Information
CategoryNervous System
Primary Indication (Clinical trial phases)Approved Drug Bank
Biological Information
Primary Indication (Disease Category) Non Infectious Disease
Primary Indication (Disease)Parkinson disease
Secondary Indication Middle East respiratory syndrome coronavirus (MERS-CoV) NA JordanWorld Health OrganisationCDC
Secondary Indication (Approaches)Experimental-HTS
Secondary Indication (Methods)in-vitro
Secondary Indication (Model system) [cell lines/ animal models]VeroE6
Secondary Indication (Mode of viral infection)Adsorption
Secondary Indication (Viral titer)0.1 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)16.627 μM
Secondary Indication (Cell based assay)Enzyme-linked immunosorbent assay
Secondary Indication (Change)Decrease
Secondary Indication (Type of Inhibition) EC50 [ 50 % ]
ReferenceDyall J, Coleman CM, Hart BJ, Venkataraman T, Holbrook MR, Kindrachuk J, Johnson RF, Olinger GG Jr,.Repurposing of clinically developed drugs for treatment of Middle East respiratory syndrome coronavi.Antimicrob Agents Chemother. 2014 Aug;58(8):4885-93. doi: 10.1128/AAC.03036-14. Epub 2014 May 19. PMID:24841273 PubMed
CommentDrugs identified in these screens provide new targets for in vivo studies as well as incorporation into ongoing clinical studies.