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There are 13358 results for: content related to: Identification of Novel Anaplastic Lymphoma Kinase (ALK) Inhibitors Using a Common Feature Pharmacophore Model Derived from Known Ligands Crystallized with ALK

  1. Multiple e-Pharmacophore Modeling Combined with High-Throughput Virtual Screening and Docking to Identify Potential Inhibitors of β-Secretase(BACE1)

    Molecular Informatics

    Volume 32, Issue 4, April 2013, Pages: 385–398, Ravichand Palakurti, Dharmarajan Sriram, Perumal Yogeeswari and Ramakrishna Vadrevu

    Version of Record online : 15 APR 2013, DOI: 10.1002/minf.201200169

  2. You have full text access to this OnlineOpen article
    Investigation of D2 Receptor–Agonist Interactions Using a Combination of Pharmacophore and Receptor Homology Modeling

    ChemMedChem

    Volume 7, Issue 3, March 5, 2012, Pages: 471–482, Marcus Malo, Dr. Lars Brive, Prof. Kristina Luthman and Dr. Peder Svensson

    Version of Record online : 7 FEB 2012, DOI: 10.1002/cmdc.201100545

  3. Combination of Pharmacophore Matching, 2D Similarity Search, and In Vitro Biological Assays in the Selection of Potential 5-HT6 Antagonists from Large Commercial Repositories

    Chemical Biology & Drug Design

    Volume 86, Issue 4, October 2015, Pages: 864–880, Krisztina Dobi, Beáta Flachner, Mária Pukáncsik, Enikő Máthé, Melinda Bognár, Mária Szaszkó, Csaba Magyar, István Hajdú, Zsolt Lőrincz, István Simon, Ferenc Fülöp, Sándor Cseh and György Dormán

    Version of Record online : 30 APR 2015, DOI: 10.1111/cbdd.12563

  4. Discovery of Potential Integrin VLA-4 Antagonists Using Pharmacophore Modeling, Virtual Screening and Molecular Docking Studies

    Chemical Biology & Drug Design

    Volume 78, Issue 2, August 2011, Pages: 289–300, Sundarapandian Thangapandian, Shalini John, Sugunadevi Sakkiah and Keun Woo Lee

    Version of Record online : 20 JUN 2011, DOI: 10.1111/j.1747-0285.2011.01127.x

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    Pharmacophore-based discovery of inhibitors of a novel drug/proton antiporter in human brain endothelial hCMEC/D3 cell line

    British Journal of Pharmacology

    Volume 172, Issue 20, October 2015, Pages: 4888–4904, Hélène Chapy, Laura Goracci, Philippe Vayer, Yannick Parmentier, Pierre-Alain Carrupt, Xavier Declèves, Jean-Michel Scherrmann, Salvatore Cisternino and Gabriele Cruciani

    Version of Record online : 13 OCT 2015, DOI: 10.1111/bph.13258

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    Ligand-Based Virtual Screening and Molecular Docking Studies to Identify the Critical Chemical Features of Potent Cathepsin D Inhibitors

    Chemical Biology & Drug Design

    Volume 80, Issue 1, July 2012, Pages: 64–79, Sugunadevi Sakkiah, Sundarapandian Thangapandian and Keun Woo Lee

    Version of Record online : 14 MAY 2012, DOI: 10.1111/j.1747-0285.2012.01339.x

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    Pharmacophore and QSAR Studies to Design Novel Histone Deacetylase 2 Inhibitors

    Chemical Biology & Drug Design

    Volume 79, Issue 5, May 2012, Pages: 760–770, Yuhong Xiang, Zhaoyan Hou and Zhuoyong Zhang

    Version of Record online : 15 FEB 2012, DOI: 10.1111/j.1747-0285.2012.01341.x

  8. Molecular Docking Study Based on Pharmacophore Modeling for Novel PhosphodiesteraseIV Inhibitors

    Molecular Informatics

    Volume 31, Issue 6-7, July 2012, Pages: 459–471, Gülşah Çifci, Viktorya Aviyente and E. Demet Akten

    Version of Record online : 11 JUL 2012, DOI: 10.1002/minf.201100141

  9. Pharmacophore-Map-Pick: A Method to Generate Pharmacophore Models for All Human GPCRs

    Molecular Informatics

    Volume 35, Issue 2, February 2016, Pages: 81–91, Shao-Xing Dai, Gong-Hua Li, Yue-Dong Gao and Jing-Fei Huang

    Version of Record online : 25 NOV 2015, DOI: 10.1002/minf.201500075

  10. Pharmacophore Modeling, Ensemble Docking, Virtual Screening, and Biological Evaluation on Glycogen Synthase Kinase-3β

    Molecular Informatics

    Volume 33, Issue 9, September 2014, Pages: 610–626, Gang Fu, Prasanna Sivaprakasam, Olivia R. Dale, Susan P. Manly, Stephen J. Cutler and Robert J. Doerksen

    Version of Record online : 2 SEP 2014, DOI: 10.1002/minf.201400044

  11. You have full text access to this OnlineOpen article
    Investigation of D1 Receptor–Agonist Interactions and D1/D2 Agonist Selectivity Using a Combination of Pharmacophore and Receptor Homology Modeling

    ChemMedChem

    Volume 7, Issue 3, March 5, 2012, Pages: 483–494, Marcus Malo, Dr. Lars Brive, Prof. Kristina Luthman and Dr. Peder Svensson

    Version of Record online : 7 FEB 2012, DOI: 10.1002/cmdc.201100546

  12. You have free access to this content
    Pharmacophore-Based Virtual Screening to Aid in the Identification of Unknown Protein Function

    Chemical Biology & Drug Design

    Volume 80, Issue 6, December 2012, Pages: 828–842, Prema L. Mallipeddi, Manali Joshi and James M. Briggs

    Version of Record online : 11 OCT 2012, DOI: 10.1111/j.1747-0285.2012.01408.x

  13. Selective Pharmacophore Models of Dopamine D1 and D2 Full Agonists Based on Extended Pharmacophore Features

    ChemMedChem

    Volume 5, Issue 2, February 1, 2010, Pages: 232–246, Marcus Malo, Lars Brive, Kristina Luthman and Peder Svensson

    Version of Record online : 13 JAN 2010, DOI: 10.1002/cmdc.200900398

  14. An Ab Initio Method for Designing Multi-Target Specific Pharmacophores using Complementary Interaction Field of Aspartic Proteases

    Molecular Informatics

    Volume 34, Issue 6-7, June 2015, Pages: 380–393, Rama Kaalia, Amit Kumar, Ashwin Srinivasan and Indira Ghosh

    Version of Record online : 20 MAR 2015, DOI: 10.1002/minf.201400157

  15. Lead Hopping for PfDHODH Inhibitors as Antimalarials Based on Pharmacophore Mapping, Molecular Docking and Comparative Binding Energy Analysis (COMBINE): A Three-Layered Virtual Screening Approach

    Molecular Informatics

    Volume 31, Issue 10, October 2012, Pages: 711–718, Probir Kumar Ojha, Indrani Mitra, Supratik Kar, Rudra Narayan Das and Kunal Roy

    Version of Record online : 7 SEP 2012, DOI: 10.1002/minf.201200045

  16. Computational Insight into p21-Activated Kinase 4 Inhibition: A Combined Ligand- and Structure-Based Approach

    ChemMedChem

    Volume 9, Issue 5, May 2014, Pages: 1012–1022, Rui-Juan Li, Jian Wang, Zhen Xu, Wan-Xu Huang, Jia Li, Sheng-Fei Jin, Prof. Dong-Mei Zhao and Prof. Mao-Sheng Cheng

    Version of Record online : 18 MAR 2014, DOI: 10.1002/cmdc.201400016

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    A Novel Pharmacophore Model to Identify Leads for Simultaneous Inhibition of Anti-coagulation and Anti-inflammatory Activities of Snake Venom Phospholipase A2

    Chemical Biology & Drug Design

    Volume 79, Issue 4, April 2012, Pages: 431–441, Abdul Wadood, Syed Abid Ali, Rabia Sattar, Muhammad Arif Lodhi and Zaheer Ul-Haq

    Version of Record online : 30 JAN 2012, DOI: 10.1111/j.1747-0285.2011.01281.x

  18. Discovery of New Antifungal Leads via Pharmacophore Modeling and QSAR Analysis of Fungal N-Myristoyl Transferase Inhibitors Followed by In Silico Screening

    Chemical Biology & Drug Design

    Volume 78, Issue 3, September 2011, Pages: 391–407, Mutasem O. Taha, Amjad M. Qandil, Tariq Al-Haraznah, Reema Abu Khalaf, Hiba Zalloum and Amal G. Al-Bakri

    Version of Record online : 13 JUL 2011, DOI: 10.1111/j.1747-0285.2011.01160.x

  19. In Silico Predictions of Drug – Drug Interactions Caused by CYP1A2, 2C9 and 3A4 Inhibition – a Comparative Study of Virtual Screening Performance

    Molecular Informatics

    Volume 34, Issue 6-7, June 2015, Pages: 431–457, Teresa Kaserer, Martina Höferl, Klara Müller, Sebastian Elmer, Markus Ganzera, Walter Jäger and Daniela Schuster

    Version of Record online : 23 JUN 2015, DOI: 10.1002/minf.201400192

  20. Computational Insights into Ligand Selectivity of Estrogen Receptors from Pharmacophore Modeling

    Molecular Informatics

    Volume 30, Issue 6-7, June 2011, Pages: 539–549, Jing Fang , Jie Shen , Feixiong Cheng, Zhejun Xu, Guixia Liu and Yun Tang

    Version of Record online : 23 MAY 2011, DOI: 10.1002/minf.201000170