Multitargeted docking approach reveals droxidopa against DNA replication and repair-related protein of cervical cancer.

ABSTRACT: Cervical cancer begins in the cells lining the cervix and is caused by persistent infection with certain types of human papillomavirus (HPV). Initially, it has no symptoms, and later it causes pelvic pain, abnormal vaginal bleeding, and pain during intercourse. It is the fourth-ranked cancer among women, and many women die from cervical cancer every year, particularly in low-income countries and the majority could be prevented with early detection and treatment. In this study, we have taken Cervical Cancer DNA Replication and Repair-Related Protein with the PDBID- 3H15, 5VBN, and 6NT9 and performed the multitargeted molecular docking with the FDA-approved drug library using HTVS, SP and XP docking. Then, the poses were filtered with MM\GBSA for proper computations of free energy, identifie

SUBMITTER: Alsaiari AA 

PROVIDER: S-EPMC11484978 | biostudies-literature | 2024 Oct

REPOSITORIES: biostudies-literature