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Vol. 31 No. 9 (2019): Vol 31 Issue 9

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Synthesis and Molecular Drug Validations of 1H-Benzo[d]imidazol-2-amine Derivatives: Molecular Docking and its Biological Activities

https://doi.org/10.14233/ajchem.2019.22104
S.R. Ashok
Department of Studies & Research in Chemistry, Tumkur University, Tumkur-572102, India
M.K. Shivananda
Department of Studies & Research in Chemistry, Tumkur University, Tumkur-572102, India
A. Manikandan
Department of Biotechnology, Vellore Institute of Technology, Vellore-632014, India

Corresponding Author(s) : M.K. Shivananda

shivanmk@yahoo.com

Asian Journal of Chemistry, Vol. 31 No. 9 (2019): Vol 31 Issue 9

Abstract

Molecular adaptation of small molecules that are targeted as therapeutic agents is a most anticipated one in drug designing and development. In the present approach, a family of substituted 1H-benzo[d]imidazol-2-amine derivatives (5a-d and 6a-e) were effectively synthesised and testified for their molecular adaptations in order to develop them as novel medications against oxidation, inflammation and inflammation associated cancer types by means of in silico and in vitro assessments. Chronic inflammation, regardless of infectious agents, plays a vital role in various cancer development. Moreover, hypoxia-inflammation-cancer are highly associated together. Hydrogen peroxide free-radical scavenging, HRBC membrane stabilization assay and cell viability test by MTT assay (macrophage) were executed to establish antioxidant, anti-inflammatory and anticancer properties of these compounds. As the prostaglandin-endoperoxide synthase 2 is highly involved in inflammation and cancer development respectively, molecular docking was executed on the corresponding X-ray crystallographic models (PDB structures).

Keywords

1H-Benzo[d]imidazol-2-amine Molecular docking Prostaglandin-endoperoxide synthase 2 (COX-2) Biological activities
Ashok, S., Shivananda, M., & Manikandan, A. (2019). Synthesis and Molecular Drug Validations of 1H-Benzo[d]imidazol-2-amine Derivatives: Molecular Docking and its Biological Activities. Asian Journal of Chemistry, 31(9), 2057–2064. https://doi.org/10.14233/ajchem.2019.22104
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