FISETIN
DrugBank ID: db07795
DrugCentral: fisetin
Synonymous :2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-4h-1-benzopyran-4-one | 3,3’,4’,7-tetrahydroxyflavone | 3,7,3’,4’-tetrahydroxyflavone | 5-desoxyquercetin | 7,3’,4’-trihydroxyflavonol
Drug Sentece Context
Table 1. Analysis of context sentence of fisetin gene in 7 abstracts.
| pmid | sentence |
|---|---|
| 32686219 | The first senolytic drugs Dasatinib, Quercetin, Fisetin and Navitoclax were discovered using a hypothesis-driven approach. |
| 32698689 | Further, our molecular dynamics (MD) simulation and energy landscape studies with fisetin, quercetin, and kamferol revealed that these molecules bind with the hACE2-S complex with low binding free energy. |
| 33382023 | The TMPRSS2 inhibition could be one of the approaches to stop the viral entry, therefore, interaction pattern and binding energies for Fisetin and TMPRSS2 have been explored in the present study. […] Molecular docking score and MMGBSA Binding energy of Fisetin was better than Nafamostat, a known inhibitor of TMPRSS2. […] Post docking MM-GBSA free energy for Fisetin and Nafamostat was -42.78 and -21.11 kcal/mol, respectively. […] Fisetin forms H bond with Val 25, His 41, Lys 42, Lys 45, Glu 44, Ser186. […] RMSD plots of TMPRSS2, TMPRSS2-Fisetin and TMPRSS2-Nafamostat complex showed stable profile with very small fluctuation during entire simulation of 150 ns. […] Significant decrease in TMPRSS2-Fisetin and TMPRSS2-Nafamostat complex fluctuation occurred around His 41, Glu 44, Gly 136, Ser 186 in RMSF study. […] During simulation Fisetin interaction was observed with residues Val 25, His 41, Glu 44, Lys 45, Lys 87, Gly 136, Gln 183, Ser 186 likewise interaction of Nafamostat with Lys 85, Asp 90, Asn 163, Asp 203 and Ser 205. […] Post simulation MM-GBSA free energy was found to be -51.87 ± 4.3 and -48.23 ± 4.39 kcal/mol for TMPRSS2 with Fisetin and Nafamostat, respectively. |