Identification of EGFR inhibitors as potential agents for cancer therapy: pharmacophore-based modeling, molecular docking, and molecular dynamics investigations.

Autor: Ashiru MA; Department of Chemical Sciences, Biochemistry Unit, College of Natural and Applied Sciences, Fountain University, Osogbo, Osun State, Nigeria., Ogunyemi SO; Faculty of Basic Medical Sciences, Department of Biochemistry, College of Medicine, University of Lagos, Lagos, Lagos State, Nigeria., Temionu OR; Department of Medical Laboratory Technology, Lagos State College of Health Technology, Lagos, Lagos State, Nigeria., Ajibare AC; Faculty of Basic Medical Sciences, Department of Biochemistry, College of Medicine, University of Lagos, Lagos, Lagos State, Nigeria., Cicero-Mfon NC; Faculty of Basic Medical Sciences, Department of Biochemistry, College of Medicine, University of Lagos, Lagos, Lagos State, Nigeria., Ihekuna OA; Faculty of Basic Medical Sciences, Department of Biochemistry, College of Medicine, University of Lagos, Lagos, Lagos State, Nigeria., Jagun MO; Department of Medical Laboratory Technology, Lagos State College of Health Technology, Lagos, Lagos State, Nigeria., Abdulmumin L; Faculty of Basic Medical Sciences, Department of Biochemistry, College of Medicine, University of Lagos, Lagos, Lagos State, Nigeria., Adisa QK; Department of Chemical Sciences, Biochemistry Unit, College of Natural and Applied Sciences, Fountain University, Osogbo, Osun State, Nigeria., Asibor YE; Faculty of Science, Department of Pure & Applied Chemistry, Osun State University, Osogbo, Osun State, Nigeria., Okorie CJ; Faculty of Physical Sciences, Department of Pure & Industrial Chemistry, Nnamdi Azikiwe University, Awka, Anambra State, Nigeria., Lawal MO; Faculty of Basic Medical Sciences, Department of Biochemistry, Ladoke Akintola University of Technology, Ogbomoso, Oyo State, Nigeria., Babalola MO; Faculty of Basic Medical Sciences, Department of Biochemistry, College of Medicine, University of Lagos, Lagos, Lagos State, Nigeria., Abdulrasaq IT; Faculty of Basic Medical Sciences, Department of Biochemistry, College of Medicine, University of Lagos, Lagos, Lagos State, Nigeria., Salau LB; Faculty of Basic Medical Science, Department of Physiology, University of Lagos, Lagos, Nigeria., Olatunji IO; Faculty of Basic Medical Sciences, Department of Biochemistry, Ladoke Akintola University of Technology, Ogbomoso, Oyo State, Nigeria., Bankole MA; Faculty of Basic Medical Sciences, Department of Biochemistry, Ladoke Akintola University of Technology, Ogbomoso, Oyo State, Nigeria., Daud AB; Faculty of Basic Medical Sciences, Department of Biochemistry, Ladoke Akintola University of Technology, Ogbomoso, Oyo State, Nigeria., Adeyemi AO; Department of Medical Laboratory Technology, Lagos State College of Health Technology, Lagos, Lagos State, Nigeria. ayodejioadeyemi@gmail.com.

Publikováno v: Journal of molecular modeling [J Mol Model] 2023 Apr 04; Vol. 29 (5), pp. 128. Date of Electronic Publication: 2023 Apr 04.