title: Insilico docking study of compounds elucidated from helicteres isora fruits with ampkinase- insulin receptor.
abstract: Insulin receptor (IR) proteins were essential intracellular signaling peptides in the insulin action cascade. Insulin receptor substrate proteins (IRS-1and IRS-2) serve and regulate the insulin level in the normal insulin action. The broad role of IRS-1 and IRS-2 in cell growth and survival reveals a common regulatory pathway linking development, somatic growth, fertility, neuronal proliferation, and aging to the core mechanisms used by vertebrates for nutrient sensing. Such type of proteins were cyclic adenosine monophosphate-activated protein kinase, this proteins play a key role in the insulin response and regulation. Type -2 Diabetes mellitus occurs during prolonged periods of peripheral insulin resistance due to inactivation of IRS proteins. The compounds isolated from the medicinal plants were safer than synthetic drugs and possess high bio activity. In the present study, four compounds were elucidated from fruits of Helicteres isora. The elucidated compounds were evaluated for the antidiabetic activity using in silico docking study. The receptor was analyzed for the active site and pocket finder tools. The aminoacids such as Phenylalanine, Lysine, Glutamic acid and Asparigine were predicted as active site binding residues. Docking studies were done through Autodock 4 software. All the compounds from fruits of Helicteres isora showed good docking profiles with AMP Kinase, except compound-3 (1,2,3,4-tetrahydro-1,5,6,8-tetramethyl-7-(2-methylprop-1-enylnaphthalene-4-ylpivalate). Finally the result from the study demonstrates that the HS-1, HS-2 and HS-4 posses potent anti diabetic activity against type-2 diabetes mellitus through drug action on AMP kinase cascade system.
authors: King Institute of Preventive Medicine and Research, Guindy, Chennai-600032.
authors: Subramanium
authors: S
authors: Vennila
authors: King Institute of Preventive Medicine and Research, Guindy, Chennai-600032.
authors: Giridharan
authors: G
authors: Bupesh
authors: King Institute of Preventive Medicine and Research, Guindy, Chennai-600032.
authors: Krishnan
authors: K
authors: Saravanamurali
authors: King Institute of Preventive Medicine and Research, Guindy, Chennai-600032.
authors: Viajayan
authors: V
authors: SenthilKumar
authors: King Institute of Preventive Medicine and Research, Guindy, Chennai-600032.
authors: Ramalingam
authors: R
authors: SenthilRaja
authors: King Institute of Preventive Medicine and Research, Guindy, Chennai-600032.
authors: Natarajan
authors: N
authors: Saran
authors: King Institute of Preventive Medicine and Research, Guindy, Chennai-600032.
authors: Sachidanandam
authors: S
authors: Magesh
keywords: Antidiabetic activity; Autodock; Helicteres isora; Insulin receptor substrate proteins; Protein-drug docking; Q-site finder