677
Views
1
CrossRef citations to date
0
Altmetric
Original Articles

Molecular docking and QSAR analysis of a few Gama amino butyric acid aminotransferase inhibitors

, &
Pages 41-53 | Received 23 Jun 2017, Accepted 08 Jan 2018, Published online: 06 Mar 2019

References

  • L.P.YemadjeD.HoinonatoF.QuentM.Druet-CabanacP.M.PreuxUnderstanding the differences in prevalence of epilepsy in tropical regionsEpilepsia52201113761381
  • Guerrini R. Epilepsy in children. Seminar at Department of child Neurology and Psychiatry. University of Pisa and IRCCS Foundazionestella Maris; 2006:367;499–524.
  • F.G.DantasG.A.CaririA.R.FilhoKnowledge and attitudes towards epilepsy among primary, secondary and tertiary level teachersNeurology-Psiquiatar592001712716
  • M.KabirZ.IliyasuI.S.AbubakarZ.S.KabirA.U.FarinYaroKnowledge, attitude and belief about epilepsy among adults in a Northern Nigeria Urban communityAnn Africa Med42012107112
  • L.L.AtshunlerDepression, anxiety and temporal lobe epilepsy. Laterality of focus and symptomsArch Neurol41990284288
  • K.I.OsolodkinV.I.ChupakhinV.A.PalyulinN.S.ZefirovMolecular modeling of ligand-receptor interaction in GABAc receptorJ Mol Graphics Mod72009813821
  • A.J.SmithP.B.SimpsonMethodological approaches for the study of GABAA receptor pharmacology and functional responsesAnal Bioanal Chem3772003843851
  • A.KarlssonF.FonnumD.Malthe-SorenssenJ.Storm-MathisenEffect of the convulsive agent 3 mercaptopropionic acid on the levels of GABA, other amino acids and glutamate decarboxylase in different regions of the rat brainJ Biochem Pharmacol23197430533061
  • P.Krogsgaard-LarsenGamma aminobutyric acid agonists, antagonists, and uptake inhibitors: design and therapeutic aspectsJ Med Chem24198113771383
  • P.StoriciG.CapitaniD.D.BaiseM.MoserR.A.JohnJ.N.Jansoniuset al.Crystal structure of GABA aminotransferase, a target for antiepileptic drug therapyBiochemistry38199986288634
  • T.XuS.M.BajjaliehSV2 modulates the size of the readily releasable pool of secretory vesiclesNat Cell Biol32002691698
  • M.A.DichterM.J.BrodieNew antiepileptic drugsEnglish J Med336199615831590
  • B.A.MalawskS.GobaillSynthesis, physicochemical and pharmacological properties N-substituted amides of α-piperazine-gamma-hydroxybutyric acidPhamarzie501995390
  • E.YurievM.AgostinoP.A.RamslandChallenges and advances in computational docking: in reviewJ Mol Recognit242009149164
  • C.MuraC.E.McAnanyAn introduction to biomolecular simulations and dockingMol Simul402014732764
  • A.A.TantarS.ConilleauS.B.ParentN.MelabL.BrilletS.Royet al.Docking and biomolecular simulations on computer grids: Status and trendsCurr Comput-Aided Drug Des42008235249
  • C.HanschA.LeoQ.S.A.R.ExploringFundamentals and applications in chemistry and biology1995American Chemical SocietyWashington, DC
  • H.KubinyiDrug Discovery Today21997457467
  • O.Ivanciuc3D QSAR ModelsM.V.DiudeaQSPR/QSAR Studies by Molecular Descriptors2001Nova ScienceHuntington, N.Y.
  • C.HanschA.LeoD.E.HoekmanQ.S.A.R.ExploringFundamentals and application in chemistry and biology1995Am Chem SocWashington, DC, USA
  • S.MaroneI.RozasD.F.WeaverTheoretical structural analyses of tricyclic neuroactive drugs: quantum pharmacologic descriptors for clustering anticonvulsant, antidepressant, and antipsychotic activitiesJ Mol Struct (Theochem)46719992530
  • M.MarderM.G.EstiuL.B.BlanchH.ViolaC.WasowskiJ.H.MedinaMolecular modeling and QSAR analysis of the interaction of flavones derivatives with the benzodiazepine site of GABAA receptor complexBioorg Med Chem92001323335
  • H.VerliM.G.AlbuquerqueR.Bicca de AlencastroE.J.BarreiroLocal intersection volume: a new 3D descriptor applied to develop a 3D-QSAR pharmacophore model for benzodiazepine receptor ligandsEur J Med Chem372002219229
  • A.J.JinH.KohnC.BéguinS.V.AndurkarJ.P.StablesD.E.WeaverA quantitative structure activity relationship study for Alpha_-substituted acetamido-N-benzylacetamide derivatives – A novel anticonvulsant drug classCan J Chem8320053745
  • Kikkeri P. Harish A. Kikkeri N. Mohana N. Lingappa M. Synthesis of indazole substituted-1,3,4-thiadiazoles and their anticonvulsant activity; drug invention today 2013;5:9 2–9.
  • Kikkeri P. Harish KN. Mohana A, et al. Synthesis of pyrazine substituted 1,3,4-thiadiazole derivatives and their anticonvulsant activity. Hindawi Publishing Corporation Organic Chemistry International; 2013. p. 8.
  • Mohamed A. Adel G. Ahmed EL. Lingappa M. Synthesis and biological evaluation of some [1,2,4]Triazolo[4,3-a]quinoxaline derivatives as novel anticonvulsant agents. Hindawi Publishing Corporation Organic Chemistry; 2013. p. 7.
  • S.RubaM.ArooG.NazIOSR J Pharm Biol Sci920141523
  • Anonymous. Wavefunction. Inc., Spartan’14, version 1.1.2. Irvine, California, USA; 2013.
  • O.TrottA.J.OlsonAutoDock Vina: improving the speed and accuracy of docking with a new scoring function, efficient optimization, and multithreadingJ Comput Chem312010455461
  • G.M.MorrisR.HueyW.LindstromM.F.SannerR.K.BelewD.S.Goodsellet al.J Comput Chem3200927852791
  • Accelrys Software Inc., Discovery Studio Visualizer 4.1, Accelrys Software Inc., San -Diego, CA, USA; 2013.
  • Yap Chun Wei; Inc., PaDEL-Descriptor,version 2.18; 2011.
  • V.RavinchandranH.RajakA.JainS.SivadasanC.P.VargheseR.Kishore-AgrawalValidation of QSAR models-strategies and importanceInt J Drug Des Discov22011511519
  • R.H.MyersClassical and modern regression application2nd ed.1990Duxbury PressCA
  • D.T.StantonP.C.JursDevelopment and use of charged partial surface area structural descriptors in computer assisted quantitative structure property relationship studiesAnal Chem62199023232329
  • D.T.StantonS.DimitrovV.GrancharovO.G.MekenyanCharged partial surface area (CPSA) descriptors QSAR applicationsSAR and QSAR Environ Res1322002341351
  • R.TodeschiniP.GramaticaNew 3D molecular descriptors: the WHIM theory and QSAR applicationsPerspect Drug Discovery Des1998355380
  • H.IftikharS.BatoolA.DeepN.BalasubramanianC.S.PrabodhM.ManavIn silico analysis of the inhibitory activities of GABA derivatives on 4-aminobutyrate transaminaseArabian J Chem032013007