biostudies-literatureUnknown28(2)Usmani JSepsis is a serious health concern globally, which necessitates understanding the root cause of infection for the prevention of proliferation inside the host's body. Phytochemicals present in plants exhibit antibacterial and anti-proliferative properties stipulated for sepsis treatment. The aim of the study was to determine the potential role of <i>Carica papaya</i> leaf extract for sepsis treatment in silico and in vitro. We selected two phytochemical compounds, carpaine and quercetin, and docked them with bacterial proteins, heat shock protein (PDB ID: 4PO2), surfactant protein D (PDB ID: 1PW9), and lactobacillus bacterial protein (PDB ID: 4MKS) against imipenem and cyclophosphamide. Quercetin showed the strongest interaction with 1PW9 and 4MKS proteins. The leaves were extracted using eMolecules (Basel, Switzerland)574https://www.ebi.ac.uk/biostudies/studies/S-EPMC9862608biostudies-literatureMolecular Docking of Bacterial Protein Modulators and Pharmacotherapeutics of <i>Carica papaya</i> Leaves as a Promising Therapy for Sepsis: Synchronising In Silico and In Vitro Studies.PMC9862608Kausar HAhmad RAkbar SHassan MJAnsari MNRashid SMir SRUsmani JSartaj ASharma MfalseMolecular Docking of Bacterial Protein Modulators and Pharmacotherapeutics of <i>Carica papaya</i> Leaves as a Promising Therapy for Sepsis: Synchronising In Silico and In Vitro Studies.Sepsis is a serious health concern globally, which necessitates understanding the root cause of infection for the prevention of proliferation inside the host's body. Phytochemicals present in plants exhibit antibacterial and anti-proliferative properties stipulated for sepsis treatment. The aim of the study was to determine the potential role of <i>Carica papaya</i> leaf extract for sepsis treatment in silico and in vitro. We selected two phytochemical compounds, carpaine and quercetin, and docked them with bacterial proteins, heat shock protein (PDB ID: 4PO2), surfactant protein D (PDB ID: 1PW9), and lactobacillus bacterial protein (PDB ID: 4MKS) against imipenem and cyclophosphamide. Quercetin showed the strongest interaction with 1PW9 and 4MKS proteins. The leaves were extracted using e2023-01-01T00:00:00Z2023 Jan2025-04-04T14:30:37.81Z2024-12-03T16:00:10.643ZS-EPMC98626083667763210.3390/molecules28020574