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Wyszukujesz frazę ""polypharmacology"" wg kryterium: Temat


Tytuł :
Risks of potential drug-drug interactions in COVID-19 patients treated with corticosteroids: a single-center experience.
Autorzy :
Cattaneo D; Gestione Ambulatoriale Politerapie (GAP) Outpatient Clinic, ASST Fatebenefratelli-Sacco University Hospital, Milan, Italy.; Unit of Clinical Pharmacology, ASST Fatebenefratelli-Sacco University Hospital, Milan, Italy.
Pasina L; Istituto Di Ricerche Farmacologiche Mario Negri IRCCS, Milan, Italy.
Conti F; Department of Infectious Diseases, ASST Fatebenefratelli-Sacco University Hospital, Via GB Grassi 74, 20157, Milano, Italy.
Giacomelli A; Department of Infectious Diseases, ASST Fatebenefratelli-Sacco University Hospital, Via GB Grassi 74, 20157, Milano, Italy.
Oreni L; Department of Infectious Diseases, ASST Fatebenefratelli-Sacco University Hospital, Via GB Grassi 74, 20157, Milano, Italy.
Pezzati L; Department of Infectious Diseases, ASST Fatebenefratelli-Sacco University Hospital, Via GB Grassi 74, 20157, Milano, Italy.
Bonazzetti C; Department of Infectious Diseases, ASST Fatebenefratelli-Sacco University Hospital, Via GB Grassi 74, 20157, Milano, Italy.
Piscaglia M; Department of Infectious Diseases, ASST Fatebenefratelli-Sacco University Hospital, Via GB Grassi 74, 20157, Milano, Italy.
Carrozzo G; Department of Infectious Diseases, ASST Fatebenefratelli-Sacco University Hospital, Via GB Grassi 74, 20157, Milano, Italy.
Antinori S; Department of Infectious Diseases, ASST Fatebenefratelli-Sacco University Hospital, Via GB Grassi 74, 20157, Milano, Italy.
Gervasoni C; Gestione Ambulatoriale Politerapie (GAP) Outpatient Clinic, ASST Fatebenefratelli-Sacco University Hospital, Milan, Italy. .; Department of Infectious Diseases, ASST Fatebenefratelli-Sacco University Hospital, Via GB Grassi 74, 20157, Milano, Italy. .
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Źródło :
Journal of endocrinological investigation [J Endocrinol Invest] 2021 Dec; Vol. 44 (12), pp. 2849-2851. Date of Electronic Publication: 2021 May 30.
Typ publikacji :
Journal Article
MeSH Terms :
Adrenal Cortex Hormones*/classification
Adrenal Cortex Hormones*/pharmacology
Drug Interactions*
Drug-Related Side Effects and Adverse Reactions*/diagnosis
Drug-Related Side Effects and Adverse Reactions*/epidemiology
Drug-Related Side Effects and Adverse Reactions*/etiology
Drug-Related Side Effects and Adverse Reactions*/prevention & control
Multiple Chronic Conditions*/drug therapy
Multiple Chronic Conditions*/epidemiology
Polypharmacology*
Pharmaceutical Preparations/*classification
Risk Adjustment/*methods
Aged ; COVID-19/diagnosis ; COVID-19/drug therapy ; COVID-19/epidemiology ; Female ; Hospitalization/statistics & numerical data ; Humans ; Italy/epidemiology ; Male ; Pharmacokinetics ; Retrospective Studies ; Risk Assessment ; SARS-CoV-2 ; Treatment Outcome
Czasopismo naukowe
Tytuł :
Quantitative Polypharmacology Profiling Based on a Multifingerprint Similarity Predictive Approach.
Autorzy :
Ciriaco F; Dipartimento di Chimica, Università degli Studi di Bari 'Aldo Moro', Via E. Orabona, 4, I-70126 Bari, Italy.
Gambacorta N; Dipartimento di Farmacia-Scienze del Farmaco, Università degli Studi di Bari 'Aldo Moro', Via E. Orabona, 4, I-70126 Bari, Italy.
Alberga D; Dipartimento di Farmacia-Scienze del Farmaco, Università degli Studi di Bari 'Aldo Moro', Via E. Orabona, 4, I-70126 Bari, Italy.
Nicolotti O; Dipartimento di Farmacia-Scienze del Farmaco, Università degli Studi di Bari 'Aldo Moro', Via E. Orabona, 4, I-70126 Bari, Italy.
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Źródło :
Journal of chemical information and modeling [J Chem Inf Model] 2021 Oct 25; Vol. 61 (10), pp. 4868-4876. Date of Electronic Publication: 2021 Sep 27.
Typ publikacji :
Journal Article; Research Support, Non-U.S. Gov't
MeSH Terms :
Algorithms*
Polypharmacology*
Ligands ; Proteins ; Reproducibility of Results
Czasopismo naukowe
Tytuł :
Polypharmacy in Heart Failure with Reduced Ejection Fraction: Progress, Not Problem.
Autorzy :
Rao VN; Division of Cardiology, Duke University Medical Center, Durham, NC; Duke Clinical Research Institute, Durham, NC.
Fudim M; Division of Cardiology, Duke University Medical Center, Durham, NC; Duke Clinical Research Institute, Durham, NC.
Savarese G; Division of Cardiology, Department of Medicine, Karolinska Institutet, Stockholm, Sweden.
Butler J; Department of Medicine, University of Mississippi Medical Center, Jackson. Electronic address: .
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Źródło :
The American journal of medicine [Am J Med] 2021 Sep; Vol. 134 (9), pp. 1068-1070. Date of Electronic Publication: 2021 May 01.
Typ publikacji :
Editorial; Research Support, N.I.H., Extramural; Research Support, Non-U.S. Gov't
MeSH Terms :
Heart Failure*/drug therapy
Heart Failure*/physiopathology
Patient Selection*
Polypharmacology*
Polypharmacy*
Risk Assessment*
Aging/*physiology
Comorbidity ; Humans ; Practice Guidelines as Topic ; Professional Practice Gaps ; Stroke Volume
Raport
Tytuł :
ePharmaLib: A Versatile Library of e-Pharmacophores to Address Small-Molecule (Poly-)Pharmacology.
Autorzy :
Moumbock AFA; Institute of Pharmaceutical Sciences, Faculty of Chemistry and Pharmacy, Albert-Ludwigs-Universität Freiburg, Hermann-Herder-Straße 9, D-79104 Freiburg, Germany.; Institute of Organic Chemistry, Faculty of Chemistry and Pharmacy, Albert-Ludwigs-Universität Freiburg, Albertstraße 21, D-79104 Freiburg, Germany.
Li J; Institute of Pharmaceutical Sciences, Faculty of Chemistry and Pharmacy, Albert-Ludwigs-Universität Freiburg, Hermann-Herder-Straße 9, D-79104 Freiburg, Germany.
Tran HTT; Institute of Pharmaceutical Sciences, Faculty of Chemistry and Pharmacy, Albert-Ludwigs-Universität Freiburg, Hermann-Herder-Straße 9, D-79104 Freiburg, Germany.; Molecular Preventive Medicine, University Medical Center and Faculty of Medicine, Albert-Ludwigs-Universität Freiburg, Engesserstaße 4, D-79108 Freiburg, Germany.
Hinkelmann R; Institute of Organic Chemistry, Faculty of Chemistry and Pharmacy, Albert-Ludwigs-Universität Freiburg, Albertstraße 21, D-79104 Freiburg, Germany.
Lamy E; Molecular Preventive Medicine, University Medical Center and Faculty of Medicine, Albert-Ludwigs-Universität Freiburg, Engesserstaße 4, D-79108 Freiburg, Germany.
Jessen HJ; Institute of Organic Chemistry, Faculty of Chemistry and Pharmacy, Albert-Ludwigs-Universität Freiburg, Albertstraße 21, D-79104 Freiburg, Germany.
Günther S; Institute of Pharmaceutical Sciences, Faculty of Chemistry and Pharmacy, Albert-Ludwigs-Universität Freiburg, Hermann-Herder-Straße 9, D-79104 Freiburg, Germany.
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Źródło :
Journal of chemical information and modeling [J Chem Inf Model] 2021 Jul 26; Vol. 61 (7), pp. 3659-3666. Date of Electronic Publication: 2021 Jul 08.
Typ publikacji :
Journal Article; Research Support, Non-U.S. Gov't
MeSH Terms :
Drug Discovery*
Polypharmacology*
Databases, Protein ; Humans ; Ligands ; Prospective Studies ; Retrospective Studies
Czasopismo naukowe
Tytuł :
A versatile polypharmacology platform promotes cytoprotection and viability of human pluripotent and differentiated cells.
Autorzy :
Chen Y; National Center for Advancing Translational Sciences (NCATS), Stem Cell Translation Laboratory (SCTL), National Institutes of Health (NIH), Rockville, MD, USA.
Tristan CA; National Center for Advancing Translational Sciences (NCATS), Stem Cell Translation Laboratory (SCTL), National Institutes of Health (NIH), Rockville, MD, USA.
Chen L; National Center for Advancing Translational Sciences (NCATS), Stem Cell Translation Laboratory (SCTL), National Institutes of Health (NIH), Rockville, MD, USA.
Jovanovic VM; National Center for Advancing Translational Sciences (NCATS), Stem Cell Translation Laboratory (SCTL), National Institutes of Health (NIH), Rockville, MD, USA.
Malley C; National Center for Advancing Translational Sciences (NCATS), Stem Cell Translation Laboratory (SCTL), National Institutes of Health (NIH), Rockville, MD, USA.
Chu PH; National Center for Advancing Translational Sciences (NCATS), Stem Cell Translation Laboratory (SCTL), National Institutes of Health (NIH), Rockville, MD, USA.
Ryu S; National Center for Advancing Translational Sciences (NCATS), Stem Cell Translation Laboratory (SCTL), National Institutes of Health (NIH), Rockville, MD, USA.
Deng T; National Center for Advancing Translational Sciences (NCATS), Stem Cell Translation Laboratory (SCTL), National Institutes of Health (NIH), Rockville, MD, USA.
Ormanoglu P; National Center for Advancing Translational Sciences (NCATS), Stem Cell Translation Laboratory (SCTL), National Institutes of Health (NIH), Rockville, MD, USA.
Tao D; National Center for Advancing Translational Sciences (NCATS), Stem Cell Translation Laboratory (SCTL), National Institutes of Health (NIH), Rockville, MD, USA.
Fang Y; National Center for Advancing Translational Sciences (NCATS), Stem Cell Translation Laboratory (SCTL), National Institutes of Health (NIH), Rockville, MD, USA.
Slamecka J; National Center for Advancing Translational Sciences (NCATS), Stem Cell Translation Laboratory (SCTL), National Institutes of Health (NIH), Rockville, MD, USA.
Hong H; National Center for Advancing Translational Sciences (NCATS), Stem Cell Translation Laboratory (SCTL), National Institutes of Health (NIH), Rockville, MD, USA.
LeClair CA; National Center for Advancing Translational Sciences (NCATS), Stem Cell Translation Laboratory (SCTL), National Institutes of Health (NIH), Rockville, MD, USA.
Michael S; National Center for Advancing Translational Sciences (NCATS), Stem Cell Translation Laboratory (SCTL), National Institutes of Health (NIH), Rockville, MD, USA.
Austin CP; National Center for Advancing Translational Sciences (NCATS), Stem Cell Translation Laboratory (SCTL), National Institutes of Health (NIH), Rockville, MD, USA.
Simeonov A; National Center for Advancing Translational Sciences (NCATS), Stem Cell Translation Laboratory (SCTL), National Institutes of Health (NIH), Rockville, MD, USA.
Singeç I; National Center for Advancing Translational Sciences (NCATS), Stem Cell Translation Laboratory (SCTL), National Institutes of Health (NIH), Rockville, MD, USA. .
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Źródło :
Nature methods [Nat Methods] 2021 May; Vol. 18 (5), pp. 528-541. Date of Electronic Publication: 2021 May 03.
Typ publikacji :
Journal Article; Research Support, N.I.H., Extramural; Research Support, N.I.H., Intramural
MeSH Terms :
Polypharmacology*
Cell Differentiation/*drug effects
Cell Survival/*drug effects
Cryoprotective Agents/*pharmacology
Pluripotent Stem Cells/*drug effects
Cell Culture Techniques ; Cryopreservation/methods ; Cryoprotective Agents/chemistry ; Gene Expression Regulation/drug effects ; High-Throughput Screening Assays ; Humans ; Pluripotent Stem Cells/physiology ; rho-Associated Kinases/antagonists & inhibitors ; rho-Associated Kinases/genetics ; rho-Associated Kinases/metabolism
Czasopismo naukowe
Tytuł :
From Combinations to Single-Molecule Polypharmacology-Cromolyn-Ibuprofen Conjugates for Alzheimer's Disease.
Autorzy :
Albertini C; Department of Pharmacy and Biotechnology, Alma Mater Studiorum-University of Bologna, Via Belmeloro 6/Via Selmi 3, 40126 Bologna, Italy.
Naldi M; Department of Pharmacy and Biotechnology, Alma Mater Studiorum-University of Bologna, Via Belmeloro 6/Via Selmi 3, 40126 Bologna, Italy.; Centre for Applied Biomedical Research-CRBA, University of Bologna, St. Orsola Hospital, Via Massarenti 9, 40138 Bologna, Italy.
Petralla S; Department of Pharmacy and Biotechnology, Alma Mater Studiorum-University of Bologna, Via Belmeloro 6/Via Selmi 3, 40126 Bologna, Italy.
Strocchi S; Department of Pharmacy and Biotechnology, Alma Mater Studiorum-University of Bologna, Via Belmeloro 6/Via Selmi 3, 40126 Bologna, Italy.
Grifoni D; Department of Life, Health and Environmental Sciences (MeSVA), University of L'Aquila, Via Vetoio, Coppito 2, 67100 L'Aquila, Italy.
Monti B; Department of Pharmacy and Biotechnology, Alma Mater Studiorum-University of Bologna, Via Belmeloro 6/Via Selmi 3, 40126 Bologna, Italy.
Bartolini M; Department of Pharmacy and Biotechnology, Alma Mater Studiorum-University of Bologna, Via Belmeloro 6/Via Selmi 3, 40126 Bologna, Italy.
Bolognesi ML; Department of Pharmacy and Biotechnology, Alma Mater Studiorum-University of Bologna, Via Belmeloro 6/Via Selmi 3, 40126 Bologna, Italy.
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Źródło :
Molecules (Basel, Switzerland) [Molecules] 2021 Feb 19; Vol. 26 (4). Date of Electronic Publication: 2021 Feb 19.
Typ publikacji :
Journal Article
MeSH Terms :
Polypharmacology*
Alzheimer Disease/*drug therapy
Cromolyn Sodium/*therapeutic use
Ibuprofen/*therapeutic use
Amyloid beta-Peptides/chemistry ; Amyloid beta-Peptides/toxicity ; Animals ; Behavior, Animal/drug effects ; Cell Survival/drug effects ; Cromolyn Sodium/chemical synthesis ; Cromolyn Sodium/chemistry ; Cromolyn Sodium/pharmacology ; Drosophila/drug effects ; Drug Design ; Endocytosis/drug effects ; Ibuprofen/chemical synthesis ; Ibuprofen/chemistry ; Ibuprofen/pharmacology ; Immunomodulation/drug effects ; Mice ; Microglia/drug effects ; Microglia/metabolism ; Neurons/drug effects ; Neurons/metabolism ; Neuroprotective Agents/pharmacology ; Neurotoxins/toxicity ; Protein Aggregates/drug effects ; Rats, Wistar
Czasopismo naukowe
Tytuł :
Prediction of Promiscuity Cliffs Using Machine Learning.
Autorzy :
Blaschke T; Department of Life Science Informatics, B-IT, LIMES Program Unit Chemical Biology and Medicinal Chemistry, Rheinische Friedrich-Wilhelms-Universität, Endenicher Allee 19c, D-53115, Bonn, Germany.
Feldmann C; Department of Life Science Informatics, B-IT, LIMES Program Unit Chemical Biology and Medicinal Chemistry, Rheinische Friedrich-Wilhelms-Universität, Endenicher Allee 19c, D-53115, Bonn, Germany.
Bajorath J; Department of Life Science Informatics, B-IT, LIMES Program Unit Chemical Biology and Medicinal Chemistry, Rheinische Friedrich-Wilhelms-Universität, Endenicher Allee 19c, D-53115, Bonn, Germany.
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Źródło :
Molecular informatics [Mol Inform] 2021 Jan; Vol. 40 (1), pp. e2000196. Date of Electronic Publication: 2020 Sep 29.
Typ publikacji :
Journal Article
MeSH Terms :
Machine Learning*
Polypharmacology*
Deep Learning ; Humans ; Structure-Activity Relationship
Czasopismo naukowe
Tytuł :
Systematic Data Analysis and Diagnostic Machine Learning Reveal Differences between Compounds with Single- and Multitarget Activity.
Autorzy :
Feldmann C; Department of Life Science Informatics, B-IT, LIMES Program Unit Chemical Biology and Medicinal Chemistry, Rheinische Friedrich-Wilhelms-Universität, Endenicher Allee 19c, D-53115 Bonn, Germany.
Yonchev D; Department of Life Science Informatics, B-IT, LIMES Program Unit Chemical Biology and Medicinal Chemistry, Rheinische Friedrich-Wilhelms-Universität, Endenicher Allee 19c, D-53115 Bonn, Germany.
Stumpfe D; Department of Life Science Informatics, B-IT, LIMES Program Unit Chemical Biology and Medicinal Chemistry, Rheinische Friedrich-Wilhelms-Universität, Endenicher Allee 19c, D-53115 Bonn, Germany.
Bajorath J; Department of Life Science Informatics, B-IT, LIMES Program Unit Chemical Biology and Medicinal Chemistry, Rheinische Friedrich-Wilhelms-Universität, Endenicher Allee 19c, D-53115 Bonn, Germany.
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Źródło :
Molecular pharmaceutics [Mol Pharm] 2020 Dec 07; Vol. 17 (12), pp. 4652-4666. Date of Electronic Publication: 2020 Nov 05.
Typ publikacji :
Journal Article; Research Support, Non-U.S. Gov't
MeSH Terms :
Machine Learning*
Polypharmacology*
Drug Discovery/*methods
Data Analysis ; Molecular Structure ; Structure-Activity Relationship
Czasopismo naukowe
Tytuł :
Exploitation of dihydroorotate dehydrogenase (DHODH) and p53 activation as therapeutic targets: A case study in polypharmacology.
Autorzy :
Ladds MJGW; Department of Microbiology, Tumor and Cell Biology, Karolinska Institutet, Stockholm, Sweden; SciLifeLab, Department of Microbiology, Tumor and Cell Biology, Karolinska Institutet, Stockholm, Sweden. Electronic address: .
Popova G; Department of Microbiology, Tumor and Cell Biology, Karolinska Institutet, Stockholm, Sweden.
Pastor-Fernández A; Department of Microbiology, Tumor and Cell Biology, Karolinska Institutet, Stockholm, Sweden; SciLifeLab, Department of Microbiology, Tumor and Cell Biology, Karolinska Institutet, Stockholm, Sweden.
Kannan S; Bioinformatics Institute (BII), A*STAR, Singapore.
van Leeuwen IMM; Department of Microbiology, Tumor and Cell Biology, Karolinska Institutet, Stockholm, Sweden.
Håkansson M; SARomics Biostructures AB, Lund, Sweden.
Walse B; SARomics Biostructures AB, Lund, Sweden.
Tholander F; Department of Medical Biochemistry and Biophysics, Karolinska Institutet, Stockholm, Sweden.
Bhatia R; Division of Hematology and Oncology, O'Neal Comprehensive Cancer Center, University of Alabama, Birmingham, Alabama, USA.
Verma CS; Bioinformatics Institute (BII), A*STAR, Singapore; Department of Biological Sciences, National University of Singapore, Singapore; School of Biological Sciences, Nanyang Technological University, Singapore.
Lane DP; Department of Microbiology, Tumor and Cell Biology, Karolinska Institutet, Stockholm, Sweden; SciLifeLab, Department of Microbiology, Tumor and Cell Biology, Karolinska Institutet, Stockholm, Sweden.
Laín S; Department of Microbiology, Tumor and Cell Biology, Karolinska Institutet, Stockholm, Sweden; SciLifeLab, Department of Microbiology, Tumor and Cell Biology, Karolinska Institutet, Stockholm, Sweden. Electronic address: .
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Źródło :
The Journal of biological chemistry [J Biol Chem] 2020 Dec 25; Vol. 295 (52), pp. 17935-17949. Date of Electronic Publication: 2020 Sep 08.
Typ publikacji :
Journal Article; Research Support, N.I.H., Extramural; Research Support, Non-U.S. Gov't
MeSH Terms :
Polypharmacology*
Acetanilides/*pharmacology
Enzyme Inhibitors/*pharmacology
Neoplasms/*drug therapy
Oxidoreductases Acting on CH-CH Group Donors/*antagonists & inhibitors
Sirtuin 1/*antagonists & inhibitors
Thiourea/*analogs & derivatives
Tumor Suppressor Protein p53/*metabolism
Autophagy ; Cell Proliferation ; Dihydroorotate Dehydrogenase ; Humans ; Neoplasms/metabolism ; Neoplasms/pathology ; Oxidoreductases Acting on CH-CH Group Donors/metabolism ; Thiourea/pharmacology ; Tumor Cells, Cultured ; Tumor Suppressor Protein p53/genetics
Czasopismo naukowe
Tytuł :
Training primary care professionals in multimorbidity management: Educational assessment of the eMULTIPAP course.
Autorzy :
Leiva-Fernández F; Teaching Unit for Family and Community Primary Care Health District Málaga/Guadalhorce, Andalusian Health Service, Málaga, Spain; Biomedical Research Institute of Málaga -IBIMA-, University of Malaga, Spain; Health Services and Chronic Conditions Research Network (REDISSEC), Health Institute Carlos III, Madrid, Spain. Electronic address: .
Prados-Torres JD; Teaching Unit for Family and Community Primary Care Health District Málaga/Guadalhorce, Andalusian Health Service, Málaga, Spain; Biomedical Research Institute of Málaga -IBIMA-, University of Malaga, Spain; Health Services and Chronic Conditions Research Network (REDISSEC), Health Institute Carlos III, Madrid, Spain. Electronic address: .
Prados-Torres A; Health Services and Chronic Conditions Research Network (REDISSEC), Health Institute Carlos III, Madrid, Spain; EpiChron Research Group, Aragon Health Sciences Institute (IACS), IIS Aragón, Miguel Servet University Hospital, Zaragoza, Spain. Electronic address: .
Del-Cura-González I; Health Services and Chronic Conditions Research Network (REDISSEC), Health Institute Carlos III, Madrid, Spain; Research Unit, Primary Health Care Management of Madrid, Madrid Health Service, Spain; Public Health and Preventive Medicine Area, University Rey Juan Carlos, Madrid, Spain. Electronic address: .
Castillo-Jimena M; Teaching Unit for Family and Community Primary Care Health District Málaga/Guadalhorce, Andalusian Health Service, Málaga, Spain; Biomedical Research Institute of Málaga -IBIMA-, University of Malaga, Spain; Primary Care Health Centre Coín, Health District Málaga-Guadalhorce, Andalusian Health Service, Málaga, Spain. Electronic address: .
López-Rodríguez JA; Health Services and Chronic Conditions Research Network (REDISSEC), Health Institute Carlos III, Madrid, Spain; Research Unit, Primary Health Care Management of Madrid, Madrid Health Service, Spain; Public Health and Preventive Medicine Area, University Rey Juan Carlos, Madrid, Spain; Primary Care Health Centre General Ricardos, Madrid Health Service, Spain. Electronic address: .
Rogero-Blanco ME; Primary Care Health Centre General Ricardos, Madrid Health Service, Spain. Electronic address: .
Lozano-Hernández CM; Health Services and Chronic Conditions Research Network (REDISSEC), Health Institute Carlos III, Madrid, Spain; Research Unit, Primary Health Care Management of Madrid, Madrid Health Service, Spain. Electronic address: .
López-Verde F; Teaching Unit for Family and Community Primary Care Health District Málaga/Guadalhorce, Andalusian Health Service, Málaga, Spain; Primary Care Health Centre Las Delicias, Health District Málaga-Guadalhorce, Andalusian Health Service, Málaga, Spain. Electronic address: .
Bujalance-Zafra MJ; Teaching Unit for Family and Community Primary Care Health District Málaga/Guadalhorce, Andalusian Health Service, Málaga, Spain; Biomedical Research Institute of Málaga -IBIMA-, University of Malaga, Spain; Primary Care Health Centre Victoria, Health District Málaga-Guadalhorce, Andalusian Health Service, Málaga, Spain. Electronic address: .
Pico-Soler MV; EpiChron Research Group, Aragon Health Sciences Institute (IACS), IIS Aragón, Miguel Servet University Hospital, Zaragoza, Spain; Primary Care Health Centre Torrero-La Paz, Aragon Health Service, Zaragoza, Spain. Electronic address: .
Gimeno-Feliu LA; EpiChron Research Group, Aragon Health Sciences Institute (IACS), IIS Aragón, Miguel Servet University Hospital, Zaragoza, Spain; Primary Care Health Centre San Pablo. Aragon Health Service, Zaragoza, Spain. Electronic address: .
Poblador-Plou B; Health Services and Chronic Conditions Research Network (REDISSEC), Health Institute Carlos III, Madrid, Spain; EpiChron Research Group, Aragon Health Sciences Institute (IACS), IIS Aragón, Miguel Servet University Hospital, Zaragoza, Spain. Electronic address: .
Martinez-Cañavate MT; IAVANTE: Línea de Formación de la Fundación Progreso y Salud, Junta de Andalucía, Spain. Electronic address: .
Muth C; Institute of General Practice, Johann Wolfgang Goethe University, Frankfurt, Germany. Electronic address: .
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Corporate Authors :
MULTIPAP Group
Źródło :
Mechanisms of ageing and development [Mech Ageing Dev] 2020 Dec; Vol. 192, pp. 111354. Date of Electronic Publication: 2020 Sep 15.
Typ publikacji :
Journal Article; Randomized Controlled Trial; Research Support, Non-U.S. Gov't
MeSH Terms :
Multimorbidity*
Polypharmacology*
Education, Medical, Continuing/*methods
Physicians, Primary Care/*education
Primary Health Care/*standards
Problem-Based Learning/*methods
Aged ; Drug Therapy, Combination/methods ; Drug Therapy, Combination/standards ; Educational Measurement ; Female ; Humans ; Inappropriate Prescribing/prevention & control ; Male ; Polypharmacy ; Primary Health Care/methods ; Quality Improvement ; Staff Development/methods
Czasopismo naukowe
Tytuł :
Exploration of the mechanism of traditional Chinese medicine by AI approach using unsupervised machine learning for cellular functional similarity of compounds in heterogeneous networks, XiaoErFuPi granules as an example.
Autorzy :
Guo F; Institute of Chinese Materia Medica, China Academy of Chinese Medical Sciences, Beijing, China.
Tang X; Institute of Chinese Materia Medica, China Academy of Chinese Medical Sciences, Beijing, China; Tianjin University of Traditional Chinese Medicine, Tianjin, China.
Zhang W; Institute of Chinese Materia Medica, China Academy of Chinese Medical Sciences, Beijing, China; Chengdu University of Traditional Chinese Medicine, Chengdu, China.
Wei J; Institute of Chinese Materia Medica, China Academy of Chinese Medical Sciences, Beijing, China.
Tang S; Institute of Chinese Materia Medica, China Academy of Chinese Medical Sciences, Beijing, China. Electronic address: .
Wu H; Institute of Chinese Materia Medica, China Academy of Chinese Medical Sciences, Beijing, China. Electronic address: .
Yang H; Institute of Chinese Materia Medica, China Academy of Chinese Medical Sciences, Beijing, China; China Academy of Chinese Medical Sciences, Beijing, China. Electronic address: .
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Źródło :
Pharmacological research [Pharmacol Res] 2020 Oct; Vol. 160, pp. 105077. Date of Electronic Publication: 2020 Jul 17.
Typ publikacji :
Journal Article; Research Support, Non-U.S. Gov't
MeSH Terms :
Medicine, Chinese Traditional*
Polypharmacology*
Systems Biology*
Unsupervised Machine Learning*
Drugs, Chinese Herbal/*pharmacology
Duodenum/*drug effects
Dyspepsia/*drug therapy
Animals ; Cluster Analysis ; Drugs, Chinese Herbal/classification ; Duodenum/metabolism ; Duodenum/physiopathology ; Dyspepsia/metabolism ; Dyspepsia/physiopathology ; Gene Expression Profiling ; Gene Regulatory Networks ; Humans ; Male ; Molecular Structure ; Protein Interaction Maps ; Proteome ; Proteomics ; Rats, Sprague-Dawley ; Signal Transduction ; Structure-Activity Relationship ; Transcriptome
Czasopismo naukowe
Tytuł :
An up-to-date overview of computational polypharmacology in modern drug discovery.
Autorzy :
Chaudhari R; Intelligent Molecular Discovery Laboratory, Department of Experimental Therapeutics, The University of Texas MD Anderson Cancer Center , Houston, TX, USA.
Fong LW; Intelligent Molecular Discovery Laboratory, Department of Experimental Therapeutics, The University of Texas MD Anderson Cancer Center , Houston, TX, USA.; MD Anderson UTHealth Graduate School of Biomedical Sciences , Houston, TX, USA.
Tan Z; Intelligent Molecular Discovery Laboratory, Department of Experimental Therapeutics, The University of Texas MD Anderson Cancer Center , Houston, TX, USA.
Huang B; Intelligent Molecular Discovery Laboratory, Department of Experimental Therapeutics, The University of Texas MD Anderson Cancer Center , Houston, TX, USA.
Zhang S; Intelligent Molecular Discovery Laboratory, Department of Experimental Therapeutics, The University of Texas MD Anderson Cancer Center , Houston, TX, USA.; MD Anderson UTHealth Graduate School of Biomedical Sciences , Houston, TX, USA.
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Źródło :
Expert opinion on drug discovery [Expert Opin Drug Discov] 2020 Sep; Vol. 15 (9), pp. 1025-1044. Date of Electronic Publication: 2020 May 26.
Typ publikacji :
Journal Article; Research Support, N.I.H., Extramural; Review
MeSH Terms :
Drug Discovery*
Polypharmacology*
Computational Biology ; Computational Chemistry ; Drug Development ; Humans ; Molecular Targeted Therapy
Czasopismo naukowe
Tytuł :
From combinations to multitarget-directed ligands: A continuum in Alzheimer's disease polypharmacology.
Autorzy :
Albertini C; Department of Pharmacy and Biotechnology, Alma Mater Studiorum-University of Bologna, Bologna, Italy.
Salerno A; Department of Pharmacy and Biotechnology, Alma Mater Studiorum-University of Bologna, Bologna, Italy.
de Sena Murteira Pinheiro P; Department of Pharmacy and Biotechnology, Alma Mater Studiorum-University of Bologna, Bologna, Italy.; Programa de Pós-Graduação em Farmacologia e Química Medicinal, Instituto de Ciências Biomédicas, Universidade Federal do Rio de Janeiro, Rio de Janeiro, Rio de Janeiro, Brazil.
Bolognesi ML; Department of Pharmacy and Biotechnology, Alma Mater Studiorum-University of Bologna, Bologna, Italy.
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Źródło :
Medicinal research reviews [Med Res Rev] 2021 Sep; Vol. 41 (5), pp. 2606-2633. Date of Electronic Publication: 2020 Jun 19.
Typ publikacji :
Journal Article; Research Support, Non-U.S. Gov't; Review
MeSH Terms :
Alzheimer Disease*/drug therapy
Pharmaceutical Preparations*
Drug Discovery ; Humans ; Ligands ; Polypharmacology
Czasopismo naukowe
Tytuł :
Modelling bioactivities of combinations of whole extracts of edibles with a simplified theoretical framework reveals the statistical role of molecular diversity and system complexity in their mode of action and their nearly certain safety.
Autorzy :
Mayer P; Alphanosos, Riom, France.
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Źródło :
PloS one [PLoS One] 2020 Sep 28; Vol. 15 (9), pp. e0239841. Date of Electronic Publication: 2020 Sep 28 (Print Publication: 2020).
Typ publikacji :
Journal Article; Research Support, Non-U.S. Gov't
MeSH Terms :
Models, Biological*
Polypharmacology*
Drug Discovery/*methods
Plant Extracts/*pharmacology
Plants, Edible/*chemistry
Disease/etiology ; Drug Compounding ; Drug Synergism ; Drug Therapy ; Homeostasis ; Humans ; Nutrients ; Plant Extracts/adverse effects
Czasopismo naukowe
Tytuł :
Deep Learning Enhancing Kinome-Wide Polypharmacology Profiling: Model Construction and Experiment Validation.
Autorzy :
Li X; Drug Discovery and Design Center, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, 555 Zuchongzhi Road, Shanghai 201203, China.; University of Chinese Academy of Sciences, No. 19A Yuquan Road, Beijing 100049, China.
Li Z; Drug Discovery and Design Center, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, 555 Zuchongzhi Road, Shanghai 201203, China.; School of Information Management, Dezhou University, 566 West University Road, Dezhou 253023, China.
Wu X; Drug Discovery and Design Center, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, 555 Zuchongzhi Road, Shanghai 201203, China.; School of Pharmacy, East China University of Science and Technology, 130 Meilong Road, Shanghai 200237, China.
Xiong Z; Drug Discovery and Design Center, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, 555 Zuchongzhi Road, Shanghai 201203, China.; School of Life Science and Technology, ShanghaiTech University, 393 Huaxiazhong Road, Shanghai 200031, China.
Yang T; Drug Discovery and Design Center, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, 555 Zuchongzhi Road, Shanghai 201203, China.; University of Chinese Academy of Sciences, No. 19A Yuquan Road, Beijing 100049, China.
Fu Z; Drug Discovery and Design Center, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, 555 Zuchongzhi Road, Shanghai 201203, China.; University of Chinese Academy of Sciences, No. 19A Yuquan Road, Beijing 100049, China.
Liu X; Drug Discovery and Design Center, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, 555 Zuchongzhi Road, Shanghai 201203, China.; School of Life Science and Technology, ShanghaiTech University, 393 Huaxiazhong Road, Shanghai 200031, China.
Tan X; Drug Discovery and Design Center, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, 555 Zuchongzhi Road, Shanghai 201203, China.; University of Chinese Academy of Sciences, No. 19A Yuquan Road, Beijing 100049, China.
Zhong F; Drug Discovery and Design Center, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, 555 Zuchongzhi Road, Shanghai 201203, China.; University of Chinese Academy of Sciences, No. 19A Yuquan Road, Beijing 100049, China.
Wan X; Drug Discovery and Design Center, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, 555 Zuchongzhi Road, Shanghai 201203, China.; University of Chinese Academy of Sciences, No. 19A Yuquan Road, Beijing 100049, China.
Wang D; Drug Discovery and Design Center, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, 555 Zuchongzhi Road, Shanghai 201203, China.; University of Chinese Academy of Sciences, No. 19A Yuquan Road, Beijing 100049, China.
Ding X; Drug Discovery and Design Center, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, 555 Zuchongzhi Road, Shanghai 201203, China.; University of Chinese Academy of Sciences, No. 19A Yuquan Road, Beijing 100049, China.
Yang R; Drug Discovery and Design Center, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, 555 Zuchongzhi Road, Shanghai 201203, China.; School of Life Science and Technology, ShanghaiTech University, 393 Huaxiazhong Road, Shanghai 200031, China.
Hou H; Drug Discovery and Design Center, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, 555 Zuchongzhi Road, Shanghai 201203, China.; School of Pharmacy, Fudan University, 826 Zhangheng Road, Shanghai 201203, China.
Li C; Drug Discovery and Design Center, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, 555 Zuchongzhi Road, Shanghai 201203, China.
Liu H; Drug Discovery and Design Center, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, 555 Zuchongzhi Road, Shanghai 201203, China.
Chen K; Drug Discovery and Design Center, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, 555 Zuchongzhi Road, Shanghai 201203, China.; School of Life Science and Technology, ShanghaiTech University, 393 Huaxiazhong Road, Shanghai 200031, China.
Jiang H; Drug Discovery and Design Center, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, 555 Zuchongzhi Road, Shanghai 201203, China.; School of Life Science and Technology, ShanghaiTech University, 393 Huaxiazhong Road, Shanghai 200031, China.
Zheng M; Drug Discovery and Design Center, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, 555 Zuchongzhi Road, Shanghai 201203, China.
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Źródło :
Journal of medicinal chemistry [J Med Chem] 2020 Aug 27; Vol. 63 (16), pp. 8723-8737. Date of Electronic Publication: 2019 Aug 15.
Typ publikacji :
Journal Article; Research Support, Non-U.S. Gov't
MeSH Terms :
Deep Learning*
Polypharmacology*
Protein Kinase Inhibitors/*chemistry
Protein Kinases/*chemistry
Databases, Chemical ; Datasets as Topic ; Drug Discovery/methods
Czasopismo naukowe
Tytuł :
Drug repurposing improves disease targeting 11-fold and can be augmented by network module targeting, applied to COVID-19.
Autorzy :
Rivero-García I; Department of Biochemistry and Biophysics, Stockholm University, Science for Life Laboratory, Box 1031, 17121, Solna, Sweden.
Castresana-Aguirre M; Department of Biochemistry and Biophysics, Stockholm University, Science for Life Laboratory, Box 1031, 17121, Solna, Sweden.
Guglielmo L; Department of Biochemistry and Biophysics, Stockholm University, Science for Life Laboratory, Box 1031, 17121, Solna, Sweden.
Guala D; Department of Biochemistry and Biophysics, Stockholm University, Science for Life Laboratory, Box 1031, 17121, Solna, Sweden.
Sonnhammer ELL; Department of Biochemistry and Biophysics, Stockholm University, Science for Life Laboratory, Box 1031, 17121, Solna, Sweden. .
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Źródło :
Scientific reports [Sci Rep] 2021 Oct 19; Vol. 11 (1), pp. 20687. Date of Electronic Publication: 2021 Oct 19.
Typ publikacji :
Journal Article; Research Support, Non-U.S. Gov't
MeSH Terms :
SARS-CoV-2*
COVID-19/*drug therapy
Drug Repositioning/*methods
Gene Regulatory Networks/*drug effects
Protein Interaction Maps/*genetics
Antiviral Agents/pharmacology ; Bayes Theorem ; Computational Biology/methods ; Drug Delivery Systems ; Drug Discovery ; Humans ; Polypharmacology ; Protein Interaction Mapping ; United States ; United States Food and Drug Administration
Czasopismo naukowe
Tytuł :
Crowdsourced identification of multi-target kinase inhibitors for RET- and TAU- based disease: The Multi-Targeting Drug DREAM Challenge.
Autorzy :
Xiong Z; Shanghai Institute for Advanced Immunochemical Studies, ShanghaiTech University, Shanghai, China.
Jeon M; Department of Computer Science and Engineering, Korea University, Seoul, Republic of Korea.
Allaway RJ; Sage Bionetworks, Seattle, Washington, United States of America.
Kang J; Department of Computer Science and Engineering, Korea University, Seoul, Republic of Korea.; Interdisciplinary Graduate Program in Bioinformatics, Korea University, Seoul, Republic of Korea.
Park D; Department of Computer Science and Engineering, Korea University, Seoul, Republic of Korea.
Lee J; Department of Computer Science and Engineering, Korea University, Seoul, Republic of Korea.
Jeon H; Interdisciplinary Graduate Program in Bioinformatics, Korea University, Seoul, Republic of Korea.; Drug Discovery and Design Center, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, Shanghai, China.
Ko M; Department of Computer Science and Engineering, Korea University, Seoul, Republic of Korea.
Jiang H; Shanghai Institute for Advanced Immunochemical Studies, ShanghaiTech University, Shanghai, China.; Drug Discovery and Design Center, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, Shanghai, China.
Zheng M; Drug Discovery and Design Center, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, Shanghai, China.
Tan AC; Department of Biostatistics and Bioinformatics, Moffitt Cancer Center, Tampa, Florida, United States of America.
Guo X; Sage Bionetworks, Seattle, Washington, United States of America.
Dang KK; Sage Bionetworks, Seattle, Washington, United States of America.
Tropsha A; Laboratory for Molecular Modeling, Division of Chemical Biology and Medicinal Chemistry, UNC Eshelman School of Pharmacy, University of North Carolina, Chapel Hill, North Carolina, United States of America.
Hecht C; Department of Cell, Developmental, and Regenerative Biology, Icahn School of Medicine at Mount Sinai, New York City, New York, United States of America.
Das TK; Department of Cell, Developmental, and Regenerative Biology, Icahn School of Medicine at Mount Sinai, New York City, New York, United States of America.
Carlson HA; Department of Medicinal Chemistry, University of Michigan, Ann Arbor, Michigan, United States of America.
Abagyan R; Skaggs School of Pharmacy and Pharmaceutical Sciences, University of California, San Diego, California, United States of America.
Guinney J; Sage Bionetworks, Seattle, Washington, United States of America.
Schlessinger A; Department of Pharmacological Sciences, Icahn School of Medicine at Mount Sinai, New York City, New York, United States of America.
Cagan R; Department of Cell, Developmental, and Regenerative Biology, Icahn School of Medicine at Mount Sinai, New York City, New York, United States of America.; Institute of Cancer Sciences, University of Glasgow; Glasgow, Scotland, United Kingdom.
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Corporate Authors :
Multi-Targeting Drug DREAM Challenge Community
Źródło :
PLoS computational biology [PLoS Comput Biol] 2021 Sep 14; Vol. 17 (9), pp. e1009302. Date of Electronic Publication: 2021 Sep 14 (Print Publication: 2021).
Typ publikacji :
Journal Article; Research Support, N.I.H., Extramural; Research Support, U.S. Gov't, Non-P.H.S.
MeSH Terms :
Drug Development*
Neoplasms/*drug therapy
Protein Kinase Inhibitors/*pharmacology
Proto-Oncogene Proteins c-ret/*antagonists & inhibitors
Tauopathies/*drug therapy
Humans ; Neoplasms/metabolism ; Neural Networks, Computer ; Polypharmacology ; Protein Kinase Inhibitors/chemistry ; Protein Kinase Inhibitors/therapeutic use ; Proto-Oncogene Proteins c-ret/genetics ; Proto-Oncogene Proteins c-ret/metabolism ; tau Proteins/genetics ; tau Proteins/metabolism
Czasopismo naukowe
Tytuł :
Recent Advances in In Silico Target Fishing.
Autorzy :
Galati S; Department of Pharmacy, University of Pisa, 56126 Pisa, Italy.
Di Stefano M; Department of Pharmacy, University of Pisa, 56126 Pisa, Italy.
Martinelli E; Department of Pharmacy, University of Pisa, 56126 Pisa, Italy.
Poli G; Department of Pharmacy, University of Pisa, 56126 Pisa, Italy.
Tuccinardi T; Department of Pharmacy, University of Pisa, 56126 Pisa, Italy.; Center for Biotechnology, Sbarro Institute for Cancer Research and Molecular Medicine, College of Science and Technology, Temple University, Philadelphia, PA 19122, USA.
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Źródło :
Molecules (Basel, Switzerland) [Molecules] 2021 Aug 24; Vol. 26 (17). Date of Electronic Publication: 2021 Aug 24.
Typ publikacji :
Journal Article; Review
MeSH Terms :
Pharmaceutical Preparations/*administration & dosage
Animals ; Computer Simulation ; Drug Discovery/methods ; Drug Repositioning/methods ; Humans ; Ligands ; Molecular Docking Simulation ; Polypharmacology ; Proteins/metabolism
Czasopismo naukowe
Tytuł :
QuartataWeb: Integrated Chemical-Protein-Pathway Mapping for Polypharmacology and Chemogenomics.
Autorzy :
Li H; Department of Computational and Systems Biology School of Medicine.; Research Center for Computer-Aided Drug Discovery, Shenzhen Institutes of Advanced Technology, Chinese Academy of Sciences, Shenzhen 518055, China.
Pei F; Department of Computational and Systems Biology School of Medicine.; Drug Discovery Institute, University of Pittsburgh, Pittsburgh, PA 15213, USA.
Taylor DL; Department of Computational and Systems Biology School of Medicine.; Drug Discovery Institute, University of Pittsburgh, Pittsburgh, PA 15213, USA.
Bahar I; Department of Computational and Systems Biology School of Medicine.; Drug Discovery Institute, University of Pittsburgh, Pittsburgh, PA 15213, USA.
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Źródło :
Bioinformatics (Oxford, England) [Bioinformatics] 2020 Jun 01; Vol. 36 (12), pp. 3935-3937.
Typ publikacji :
Journal Article; Research Support, N.I.H., Extramural
MeSH Terms :
Polypharmacology*
Software*
Databases, Factual ; Humans ; Internet ; Proteins/genetics
Czasopismo naukowe
Tytuł :
Low-dose polypharmacology targeting dopamine D1 and D3 receptors reduces cue-induced relapse to heroin seeking in rats.
Autorzy :
Ewing ST; Psychology Department, Queens College of the City University of New York, Flushing, New York, USA.
Dorcely C; Psychology Department, Queens College of the City University of New York, Flushing, New York, USA.
Maidi R; Psychology Department, Queens College of the City University of New York, Flushing, New York, USA.
Paker G; Psychology Department, Queens College of the City University of New York, Flushing, New York, USA.
Schelbaum E; Psychology Department, Queens College of the City University of New York, Flushing, New York, USA.
Ranaldi R; Psychology Department, Queens College of the City University of New York, Flushing, New York, USA.
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Źródło :
Addiction biology [Addict Biol] 2021 Jul; Vol. 26 (4), pp. e12988. Date of Electronic Publication: 2021 Jan 25.
Typ publikacji :
Journal Article; Research Support, N.I.H., Extramural
MeSH Terms :
Dopamine Antagonists/*pharmacology
Drug-Seeking Behavior/*drug effects
Heroin/*administration & dosage
Animals ; Conditioning, Operant ; Cues ; Extinction, Psychological/drug effects ; Male ; Polypharmacology ; Rats ; Receptors, Dopamine D1/antagonists & inhibitors ; Recurrence ; Self Administration
Czasopismo naukowe

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