Receptor-based pharmacophore modeling, virtual screening, and molecular docking studies for the discovery of novel GSK-3β inhibitors

Ahmed M. El Kerdawy; Alaa A. Osman; Marwa A. Zaater

doi:10.1007/s00894-019-4032-5

Receptor-based pharmacophore modeling, virtual screening, and molecular docking studies for the discovery of novel GSK-3β inhibitors

Journal of Molecular Modeling ◽

10.1007/s00894-019-4032-5 ◽

2019 ◽

Vol 25 (6) ◽

Cited By ~ 3

Author(s):

Ahmed M. El Kerdawy ◽

Alaa A. Osman ◽

Marwa A. Zaater

Keyword(s):

Molecular Docking ◽

Virtual Screening ◽

Pharmacophore Modeling ◽

Docking Studies ◽

Molecular Docking Studies ◽

Gsk 3Β

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Pharmacophore Modeling, Virtual Screening, and Molecular Docking Studies for Discovery of Novel Akt2 Inhibitors

International Journal of Medical Sciences ◽

10.7150/ijms.5344 ◽

2013 ◽

Vol 10 (3) ◽

pp. 265-275 ◽

Cited By ~ 28

Author(s):

Jia Fei ◽

Lu Zhou ◽

Tao Liu ◽

Xiang-Yang Tang

Keyword(s):

Molecular Docking ◽

Virtual Screening ◽

Pharmacophore Modeling ◽

Docking Studies ◽

Molecular Docking Studies

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Pharmacophore modeling, virtual screening, molecular docking studies and density functional theory approaches to identify novel ketohexokinase (KHK) inhibitors

Biosystems ◽

10.1016/j.biosystems.2015.10.005 ◽

2015 ◽

Vol 138 ◽

pp. 39-52 ◽

Cited By ~ 12

Author(s):

Rengarajan Kavitha ◽

Subramanian Karunagaran ◽

Subramaniam Subhash Chandrabose ◽

Keun Woo Lee ◽

Chandrasekaran Meganathan

Keyword(s):

Density Functional Theory ◽

Molecular Docking ◽

Virtual Screening ◽

Density Functional ◽

Pharmacophore Modeling ◽

Docking Studies ◽

Functional Theory ◽

Molecular Docking Studies

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The Discovery of Potential MDM2 Inhibitors: A Combination of Pharmacophore Modeling, Virtual Screening, Molecular Docking Studies and In Vitro/In Vivo Biological Evaluation

ChemMedChem ◽

10.1002/cmdc.202100517 ◽

2021 ◽

Author(s):

Xuelin Zhang ◽

Chunqiao Zhou ◽

Yang Yang ◽

Hailin Liu ◽

Song Wang ◽

...

Keyword(s):

Molecular Docking ◽

Virtual Screening ◽

Pharmacophore Modeling ◽

Docking Studies ◽

Biological Evaluation ◽

Molecular Docking Studies

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A combination of pharmacophore modeling, virtual screening, and molecular docking studies for a diverse set of colchicine site inhibitors

Medicinal Chemistry Research ◽

10.1007/s00044-014-1028-7 ◽

2014 ◽

Vol 23 (11) ◽

pp. 4713-4723 ◽

Cited By ~ 4

Author(s):

Huanhuan Li ◽

Tao Liu ◽

Hongxia Xuan ◽

Senbiao Fang ◽

Chunyan Zhao

Keyword(s):

Molecular Docking ◽

Virtual Screening ◽

Pharmacophore Modeling ◽

Docking Studies ◽

Molecular Docking Studies

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Structure Based Design, Synthesis, Pharmacophore Modeling, Virtual Screening, and Molecular Docking Studies for Identification of Novel Cyclophilin D Inhibitors

Journal of Chemical Information and Modeling ◽

10.1021/ci5000196 ◽

2014 ◽

Vol 54 (3) ◽

pp. 902-912 ◽

Cited By ~ 39

Author(s):

Koteswara Rao Valasani ◽

Jhansi Rani Vangavaragu ◽

Victor W. Day ◽

Shirley ShiDu Yan

Keyword(s):

Molecular Docking ◽

Virtual Screening ◽

Pharmacophore Modeling ◽

Docking Studies ◽

Cyclophilin D ◽

Design Synthesis ◽

Molecular Docking Studies

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Discovery of Some Potent PDHK Inhibitors Using Pharmacophore Modeling, Virtual Screening and Molecular Docking Studies

Journal of Biochemistry and Molecular Biology Research ◽

10.17554/j.issn.2313-7177.2016.02.15 ◽

2016 ◽

Vol 2 (1) ◽

pp. 139-151

Author(s):

Neeta Azad ◽

◽

Mamta Bhandari ◽

Rita Kakkar

Keyword(s):

Molecular Docking ◽

Virtual Screening ◽

Pharmacophore Modeling ◽

Docking Studies ◽

Molecular Docking Studies

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Pharmacophore Modeling, Virtual Screening and Molecular Docking Studies for Identification of New Inverse Agonists of Human Histamine H1Receptor

Bulletin of the Korean Chemical Society ◽

10.5012/bkcs.2010.31.01.052 ◽

2010 ◽

Vol 31 (1) ◽

pp. 52-58 ◽

Cited By ~ 7

Author(s):

Sundarapandian Thangapandian ◽

Navaneethakrishnan Krishnamoorthy ◽

Shalini John ◽

Sugunadevi Sakkiah ◽

Prettina Lazar ◽

...

Keyword(s):

Molecular Docking ◽

Virtual Screening ◽

Pharmacophore Modeling ◽

Docking Studies ◽

Inverse Agonists ◽

Molecular Docking Studies ◽

Human Histamine

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The discovery of potential acetylcholinesterase inhibitors: A combination of pharmacophore modeling, virtual screening, and molecular docking studies

Journal of Biomedical Science ◽

10.1186/1423-0127-18-8 ◽

2011 ◽

Vol 18 (1) ◽

pp. 8 ◽

Cited By ~ 64

Author(s):

Shin-Hua Lu ◽

Josephine W Wu ◽

Hsuan-Liang Liu ◽

Jian-Hua Zhao ◽

Kung-Tien Liu ◽

...

Keyword(s):

Molecular Docking ◽

Virtual Screening ◽

Acetylcholinesterase Inhibitors ◽

Pharmacophore Modeling ◽

Docking Studies ◽

Molecular Docking Studies

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Pharmacophore modeling, virtual screening, and molecular docking studies for discovery of novel Carbonic anhydrase IX inhibitors

Medicinal Chemistry Research ◽

10.1007/s00044-011-9868-x ◽

2011 ◽

Vol 21 (11) ◽

pp. 3417-3427 ◽

Cited By ~ 3

Author(s):

Chun-Lin Lu ◽

Lu Zhou ◽

Zi-Cheng Li ◽

Xiang Gao ◽

Wei Zhang

Keyword(s):

Molecular Docking ◽

Virtual Screening ◽

Carbonic Anhydrase ◽

Pharmacophore Modeling ◽

Docking Studies ◽

Carbonic Anhydrase Ix ◽

Molecular Docking Studies

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Corrigendum to “3D-QSAR-Based Pharmacophore Modeling, Virtual Screening, and Molecular Docking Studies for Identification of Tubulin Inhibitors with Potential Anticancer Activity”

BioMed Research International ◽

10.1155/2022/9761279 ◽

2022 ◽

Vol 2022 ◽

pp. 1-2

Author(s):

Salimeh Mirzaei ◽

Razieh Ghodsi ◽

Farzin Hadizadeh ◽

Amirhossein Sahebkar

Keyword(s):

Molecular Docking ◽

Virtual Screening ◽

Anticancer Activity ◽

3D Qsar ◽

Pharmacophore Modeling ◽

Docking Studies ◽

Molecular Docking Studies ◽

Tubulin Inhibitors

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