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Identification of Interaction of Potent Inhibitors Against Dental Infections and Bio-Ceramics with IL1R1 Through Molecular Docking of Drug Designing | ||
| International Journal of Orofacial Sciences | ||
| Volume 1, Issue 1, February 2026, Pages 9-14 PDF (566.99 K) | ||
| Document Type: Original Article | ||
| DOI: 10.67593/ijos.2025.190616 | ||
| Authors | ||
| Najatallah Taha Jazzaa1; Maha Mishaal Turki2; Wafaa Tali Radef3; Ahmed AbdulJabbar Suleiman* 4 | ||
| 1College of Dentistry , University of Anbar , Anbar, Iraq | ||
| 2College of Dentistry , University of Anbar , Anbar, Iraq | ||
| 3Head quarter ,University of Anbar , Anbar, Iraq | ||
| 4Department of Biotechnology, College of Science , University of Anbar , Anbar , Iraq | ||
| Abstract | ||
| Background: Dental infection is a major issue of current time. It affects most people especially those without sufficient dental care. Bacterial and pathogenic organisms are the main cause of dental and mucosal infections in humans. Dental infections arise in the tooth structure and surrounding tissues. This type of infection commonly occurs when bacteria occupy the pulp area and surrounding tissues due to major factors such as trauma and dental procedures. In most cases, oral and dental infection leads to carcinogenesis. Dental infections may activate malignant transformation in most of the tissues related to the mouth and other organs. Dental caries and periodontal diseases are considered as top oral health diseases in the world. Around 20–50% of the population are affected by dental infections worldwide. Early diagnosis and suitable therapy may help to overcome this major issue. Methodology: This study focuses on the molecular docking of target protein with FDA approved drugs for the identification of potent inhibitor. Therefore, in this study, we have used different computational approaches to target protein structures of Interleukin-1 Receptor, type1 (IL1R1). Results and discussion: The ligands and bio-ceramic chemical compounds are docked against the IL1R1 protein and the results indicate a better affinity for specific compounds. Moreover, the interaction analysis is also carried out on the best-docked compounds with target protein which can be helpful for the identification of a lead compound that can treat dental infections effectively. | ||
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