The flavonoid compounds (n = 169) were retrieved from the PubChem database and screened using the structure-based virtual screening approach.  Finally, four potential inhibitors with PubChem CID: (4301534, 5213, 5481948, and 637080) were selected after molecular docking and drug-likeness analysis. 
PubChem
Compounds with the highest binding score were estimated through their pharmacokinetic effects by ADMET descriptors. 
ADMET descriptors
The binding free energy was computed using MM-PBSA, and the outcomes indicated that the molecules are having stable interactions with the binding site of the target protein. 
MM-PBSA