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Structure-based discovery of conformationally selective inhibitors of the serotonin transporter
Institution:1. Department of Pharmaceutical Chemistry, University of California, San Francisco, 1700 4th St., Byers Hall Suite 508D, San Francisco, CA 94143, USA;2. Department of Pharmacology, Yale University School of Medicine, 333 Cedar Street, New Haven, CT 06520-8066, USA;3. Department of Anatomy, University of California, San Francisco, San Francisco, CA 94143, USA;4. Department of Pharmacology, NIMH Psychoactive Drug Screening Program, School of Medicine, University of North Carolina at Chapel Hill, Chapel Hill, NC 27599, USA;5. Division of Chemical Biology and Medicinal Chemistry, Eshelman School of Pharmacy, University of North Carolina at Chapel Hill, Chapel Hill, NC 27599, USA;6. Department of Anesthesia and Perioperative Care, University of California, San Francisco, San Francisco, CA 94115, USA;7. Department of Psychiatry and Behavioral Sciences, Duke University Medical Center, Durham, NC 27710, USA;8. Mouse Behavioral and Neuroendocrine Analysis Core Facility, Duke University Medical Center, Durham, NC 27710, USA;9. Institute of Pharmacology, Center for Physiology and Pharmacology, Medical University of Vienna, 1090 Vienna, Austria;10. Departments of Cell Biology and Neurobiology, Duke University Medical Center, Durham, NC 27710, USA;1. Department of Automation, Tsinghua University, Beijing 100084, China;2. Institute for Brain and Cognitive Sciences, Tsinghua University, Beijing 100084, China;3. Beijing Key Laboratory of Multi-dimension & Multi-scale Computational Photography (MMCP), Tsinghua University, Beijing 100084, China;4. IDG/McGovern Institute for Brain Research, Tsinghua University, Beijing 100084, China;5. Hangzhou Zhuoxi Institute of Brain and Intelligence, Hangzhou 311100, China;6. Tsinghua-Peking Center for Life Sciences, Beijing 100084, China;7. Laboratory of Dynamic Immunobiology, Institute for Immunology, Tsinghua University, Beijing 100084, China;8. Department of Basic Medical Sciences, School of Medicine, Tsinghua University, Beijing 100084, China;9. Tsinghua Shenzhen International Graduate School, Tsinghua University, Shenzhen 518071, China;10. Department of Anesthesiology, the First Medical Center, Chinese PLA General Hospital, Beijing 100853, China;11. Beijing Key Laboratory for Immunological Research on Chronic Diseases, Tsinghua University, Beijing 100084, China;12. Beijing Frontier Research Center for Biological Structure, Tsinghua University, Beijing 100084, China;1. Department of Genetics, Yale School of Medicine, New Haven, CT 06510, USA;2. Institute for Research in Biomedicine (IRB Barcelona), The Barcelona Institute of Science and Technology, 08028 Barcelona, Spain;3. Department of Cell Biology, University of Virginia School of Medicine, Charlottesville, VA 22908, USA;4. Departments of Cell Biology and Dermatology, Yale Stem Cell Center, Yale Cancer Center, Yale School of Medicine, New Haven, CT 06510, USA;1. Institute of Metabolism and Systems Research, College of Medical and Dental Sciences, University of Birmingham, Birmingham B15 2TT, UK;2. Centre of Membrane Proteins and Receptors (COMPARE), Universities of Nottingham and Birmingham, Birmingham B15 2TT, UK;3. Research Program on Biomedical Informatics, Hospital del Mar Medical Research Institute, Department of Experimental and Health Sciences, Pompeu Fabra University, Barcelona, 08003, Spain;4. Department of Biological Sciences and Bioengineering, Indian Institute of Technology, Kanpur 208016, India;5. School of Biosciences, University of Birmingham, Birmingham B15 2TT, UK;6. Division of Physiology, Pharmacology and Neuroscience, School of Life Sciences, Queen''s Medical Centre, University of Nottingham, Nottingham NG7 2UH, UK;7. Institut für Molekulare Zellbiologie, Center for Molecular Biomedicine, Universitätsklinikum Jena, Friedrich-Schiller-Universität, Jena 07745, Germany;8. Institute of Immunology and Immunotherapy, College of Medical and Dental Sciences, University of Birmingham, Birmingham B15 2TT, UK;1. Laboratory of Genetics, The Salk Institute for Biological Studies, La Jolla, CA 92037, USA;2. Department of Psychiatry and Psychotherapy, School of Medicine, Technical University of Munich, 81675 Munich, Germany;3. Center for Organoid Systems, Technical University of Munich, 85748 Garching, Germany;4. TranslaTUM – Organoid Hub, Technical University of Munich, 81675 Munich, Germany;5. Department of Medical Neurobiology, Institute for Medical Research Israel-Canada, Faculty of Medicine, Hebrew University of Jerusalem, Jerusalem 9112102, Israel;6. Department of Cellular and Molecular Medicine, University of California, San Diego, La Jolla, CA 92093, USA;7. Waitt Advanced Biophotonics Center, The Salk Institute for Biological Studies, La Jolla, CA 92037, USA;1. Centre for Cell Biology of Chronic Disease, Institute for Molecular Bioscience, The University of Queensland, St. Lucia, QLD 4072, Australia;2. School of Biochemistry, Biomedical Sciences Building, University of Bristol, BS8 1TD Bristol, UK;3. MRC Laboratory of Molecular Biology, CB2 0QH Cambridge, UK;4. Department of Biochemistry and Pharmacology, The Bio21 Molecular Science and Biotechnology Institute, The University of Melbourne, Parkville, VIC, Australia;5. School of Biological Sciences, University of Bristol, BS8 1TD Bristol, UK;6. Cambridge Institute for Medical Research, University of Cambridge, CB2 0XY Cambridge, UK;7. Institute of Health and Sport (iHeS), Victoria University, Melbourne, VIC Australia;8. Proteomics Facility, School of Biochemistry, Biomedical Sciences Building, University of Bristol, BS8 1TD Bristol, UK;9. Department of Pediatrics and Neonatology, Nagoya City University Graduate School of Medical Sciences and Medical School, Nagoya, Japan;10. Max Planck Bristol Centre for Minimal Biology, Department of Chemistry, University of Bristol, BS8 1TS Bristol, UK;11. Murdoch Children’s Research Institute, Royal Children’s Hospital, Melbourne, VIC Australia;1. Center for Cancer Research, Massachusetts General Hospital, Boston, MA, USA;2. Cell Signaling Technology, Inc., Danvers, MA, USA;3. Department of Pathology, Immunology and Laboratory Medicine, University of Florida, Gainesville, FL, USA;4. Division of Cardiology, Harvard Medical School, Boston, MA, USA;5. Department of Obstetrics and Gynecology, Vincent Center for Reproductive Biology, Massachusetts General Hospital, Boston, MA, USA;6. Obstetrics, Gynecology and Reproductive Biology, Harvard Medical School, Boston, MA, USA;7. Division of Hematology/Oncology, Massachusetts General Hospital, Boston, MA, USA;8. Division of Nephrology, Harvard Medical School, Boston, MA, USA;9. Department of Medicine, Massachusetts General Hospital, Boston, MA, USA;10. Department of Medicine, Harvard Medical School, Boston, MA, USA;11. Department of Pathology, Massachusetts General Hospital, Boston, MA, USA;12. Department of Chemistry and Chemical Biology, Harvard University, Cambridge, MA, USA
Abstract:
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  • Keywords:serotonin transporter  functional selectivity  docking  ultra-large libraries  depression
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