Chemical, Structural, Clinical and Biological details of Antiviral agents ID: DrugRepV_5168



Chemical Information
Antiviral agent IDDrugRepV_5168
Antiviral agent nameRapamycin Drug Bank
IUPAC Name(1~{R},9~{S},12~{S},15~{R},16~{E},18~{R},19~{R},21~{R},23~{S},24~{E},26~{E},28~{E},30~{S},32~{S},35~{R})-1,18-dihydroxy-12-[(2~{R})-1-[(1~{S},3~{R},4~{R})-4-hydroxy-3-methoxycyclohexyl]propan-2-yl]-19,30-dimethoxy-15,17,21,23,29,35-hexamethyl-11,36-dioxa-4-azatricyclo[30.3.1.0^{4,9}]hexatriaconta-16,24,26,28-tetraene-2,3,10,14,20-pentone PubChem
SMILES (canonical)CC1CCC2CC(C(=CC=CC=CC(CC(C(=O)C(C(C(=CC(C(=O)CC(OC(=O)C3CCCCN3C(=O)C(=O)C1(O2)O)C(C)CC4CCC(C(C4)OC)O)C)C)O)OC)C)C)C)OC PubChem
SMILES (isomeric)C[C@@H]1CC[C@H]2C[C@@H](/C(=C/C=C/C=C/[C@H](C[C@H](C(=O)[C@@H]([C@@H](/C(=C/[C@H](C(=O)C[C@H](OC(=O)[C@@H]3CCCCN3C(=O)C(=O)[C@@]1(O2)O)[C@H](C)C[C@@H]4CC[C@H]([C@@H](C4)OC)O)C)/C)O)OC)C)C)/C)OC PubChem
Molecular FormulaC51H79NO13 PubChem
Molecular Weight (g/mol)914.187 PubChem
InChlInChI=1S/C51H79NO13/c1-30-16-12-11-13-17-31(2)42(61-8)28-38-21-19-36(7)51(60,65-38)48(57)49(58)52-23-15-14-18-39(52)50(59)64-43(33(4)26-37-20-22-40(53)44(27-37)62-9)29-41(54)32(3)25-35(6)46(56)47(63-10)45(55)34(5)24-30/h11-13,16-17,25,30,32-34,36-40,42-44,46-47,53,56,60H,14-15,18-24,26-29H2,1-10H3/b13-11+,16-12+,31-17+,35-25+/t30-,32-,33-,34-,36-,37+,38+,39+,40-,42+,43+,44-,46-,47+,51-/m1/s1 PubChem
Common NameSirolimus Drug Bank
Synonyms(-)-Rapamycin | Rapamycin | sirolimús | sirolimus | sirolimusum
Structural Information
  
Clinical Information
CategoryAntineoplastic and Immunomodulating Agents; Sensory Organ
Primary Indication (Clinical trial phases)Approved, Investigational Drug Bank
Biological Information
Primary Indication (Disease Category) Non Infectious Disease
Primary Indication (Disease)Prophylaxis of organ rejection in patients receiving renal transplants
Secondary Indication Rift Valley fever virus (RVFV) NA ZH501World Health OrganisationCDC
Secondary Indication (Approaches)Experimental
Secondary Indication (Methods)In-vitro
Secondary Indication (Model system) [cell lines/ animal models]H2.35
Secondary Indication (Mode of viral infection)Adsorption
Secondary Indication (Viral titer)5 MOI
Secondary Indication (Mode of drug delivery) Culture
Secondary Indication (Time of drug delivery) Pre infection (1 hour)
Secondary Indication (Duration of drug delivery)18 hours
Secondary Indication (Drug concentration)10 μM
Secondary Indication (Cell based assay)Plaque assay
Secondary Indication (Change)Decrease
Secondary Indication (Type of Inhibition) Viral titre [ 1 log pfu/ml ]
ReferenceBell TM, Espina V, Senina S, Woodson C, Brahms A, Carey B, Lin SC, Lundberg L, Pinkham C, Baer A, Mu.Rapamycin modulation of p70 S6 kinase signaling inhibits Rift Valley fever virus pathogenesis..Antiviral Res. 2017 Jul;143:162-175. doi: 10.1016/j.antiviral.2017.04.011. Epub 2017 Apr 23. PubMed PMID:28442428 PubMed
CommentThe phosphorylation of p70 S6 kinase was decreased following rapamycin treatment in vivo.