Cell cycle inhibition is important hallmark of anti cancer research. CDKs are divided into two types based on their Cell cycle controlling and transcriptional control. CDK 9, a transcriptional regulator serves as potential drug target. Only few drugs are under clinical trials phase 1/2/3 of CDK 9 inhibitory potential. 3BLR (pdb id) is used as docking target. Virtual screening is carried out bas...

Various proteins play important roles in diabetes and a number of plants have been tested for their efficacy in modulating diabetes. Of all the proteins, we selected aloes reductase enzyme to analyze few plant compounds computationally for their efficacy towards protein inhibition. A total of 85 compounds from different parts of a plant, Cuminum cyminum were studied. Analysis was conducted usin...

BACKGROUND Breast cancer and diabetes mellitus type-2 are two of the major diseases, which cause death to the women worldwide. Around 16% of the breast cancer patients also suffer from diabetes mellitus. It has been noted that the risk of occurrence of the breast cancer is more in patients suffering from diabetes mellitus. METHODS Owing to this, the present article deals with an objective of ...

The Hemagglutinin (HA) is a protein of influenza A virus. It is present on the surface of influenza A virus and it is a glycoprotein. The HA is identified as potential drug target. H1N1 thiazolides, proved to be a potent drug in the inhibition of H1N1 replication. It is also known as inhibitor of other strains of influenza A virus. Thiazolide drug represses viral HA's maturation at a level whic...

Several novel sulfonamide-derivatives were designed and studied their physicochemical properties to develop kinase inhibitors. Therefore, molecular docking was performed for the compounds against epidermal growth factor receptor (PDB ID: 2ITY) identify new drug candidates treating cancer. Binding free energy calculated by Molegro virtual docker (MVD) select most promising hits. The correspondin...

Antioxidant and free radical scavenging effect of black tea theaflavins has been shown in many epidemiological studies. In the present work we report the protective mechanism of tea theaflavins on biomarkers of oxidative stress, which are elevated during stress conditions. We hereby report the in vitro effect of theaflavins on erythrocyte malondialdehyde (MDA), intracellular reduced glutathione...

Molecular docking studies were carried out against γ-amino butyric acid (GABA) molecular target using Molegro Virtual Docker v 5.0 to accomplish preliminary confirmation of the observed in-vivo anticonvulsant activity. Docking studies have shown that the title compound interact and bind efficiently with 1OHY subunits of γ-amino butyric acid (GABA) enzyme which resulted in anticonvulsant activit...