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Tytuł :
The pattern of nodal morphogen signaling is shaped by co-receptor expression.
Autorzy :
Lord ND; Department of Molecular and Cellular Biology, Harvard University, Cambridge, United States.
Carte AN; Department of Molecular and Cellular Biology, Harvard University, Cambridge, United States.; Systems, Synthetic, and Quantitative Biology PhD Program, Harvard University, Cambridge, United States.; Biozentrum, University of Basel, Basel, Switzerland.
Abitua PB; Department of Molecular and Cellular Biology, Harvard University, Cambridge, United States.
Schier AF; Department of Molecular and Cellular Biology, Harvard University, Cambridge, United States.; Biozentrum, University of Basel, Basel, Switzerland.; Allen Discovery Center for Cell Lineage Tracing, University of Washington, Seattle, United States.
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Źródło :
ELife [Elife] 2021 May 26; Vol. 10. Date of Electronic Publication: 2021 May 26.
Typ publikacji :
Journal Article; Research Support, N.I.H., Extramural; Research Support, Non-U.S. Gov't; Research Support, U.S. Gov't, Non-P.H.S.
MeSH Terms :
Homeodomain Proteins/*metabolism
Intracellular Signaling Peptides and Proteins/*metabolism
Nodal Signaling Ligands/*metabolism
Transcription Factors/*metabolism
Zebrafish/*metabolism
Zebrafish Proteins/*metabolism
Animals ; Animals, Genetically Modified ; Diffusion ; Embryo, Nonmammalian/metabolism ; Gene Expression Regulation, Developmental ; Homeodomain Proteins/genetics ; Intracellular Signaling Peptides and Proteins/genetics ; Ligands ; Morphogenesis ; Mutation ; Nodal Signaling Ligands/genetics ; Signal Transduction ; Transcription Factors/genetics ; Zebrafish/embryology ; Zebrafish/genetics ; Zebrafish Proteins/genetics
Czasopismo naukowe
Tytuł :
Atypical and Asymmetric 1,3-P,N Ligands: Synthesis, Coordination and Catalytic Performance of Cycloiminophosphanes.
Autorzy :
Rong MK; Department of Chemistry and Pharmaceutical Sciences, Vrije Universiteit Amsterdam, De Boelelaan 1083, 1081 HV, Amsterdam, The Netherlands.
Holtrop F; Department of Chemistry and Pharmaceutical Sciences, Vrije Universiteit Amsterdam, De Boelelaan 1083, 1081 HV, Amsterdam, The Netherlands.
Bobylev EO; Department of Chemistry and Pharmaceutical Sciences, Vrije Universiteit Amsterdam, De Boelelaan 1083, 1081 HV, Amsterdam, The Netherlands.
Nieger M; Department of Chemistry, University of Helsinki, A. I. Virtasen aukio 1, P.O. Box 55, FIN-00014, Helsinki, Finland.
Ehlers AW; Department of Chemistry and Pharmaceutical Sciences, Vrije Universiteit Amsterdam, De Boelelaan 1083, 1081 HV, Amsterdam, The Netherlands.; Department of Chemistry, University of Johannesburg, Oakland Park, 2006, Johannesburg, South Africa.; Present address: Van 't Hoff Institute for Molecular Sciences, University of Amsterdam, P.O. Box 94157, 1090 GD, Amsterdam, The Netherlands.
Slootweg JC; Department of Chemistry and Pharmaceutical Sciences, Vrije Universiteit Amsterdam, De Boelelaan 1083, 1081 HV, Amsterdam, The Netherlands.; Present address: Van 't Hoff Institute for Molecular Sciences, University of Amsterdam, P.O. Box 94157, 1090 GD, Amsterdam, The Netherlands.
Lammertsma K; Department of Chemistry and Pharmaceutical Sciences, Vrije Universiteit Amsterdam, De Boelelaan 1083, 1081 HV, Amsterdam, The Netherlands.; Department of Chemistry, University of Johannesburg, Oakland Park, 2006, Johannesburg, South Africa.
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Źródło :
Chemistry (Weinheim an der Bergstrasse, Germany) [Chemistry] 2021 Oct 07; Vol. 27 (56), pp. 14007-14016. Date of Electronic Publication: 2021 Sep 08.
Typ publikacji :
Journal Article
MeSH Terms :
Ligands*
Catalysis
Czasopismo naukowe
Tytuł :
Robust Cr(VI) reduction over hydroxyl modified UiO-66 photocatalyst constructed from mixed ligands: Performances and mechanism insight with or without tartaric acid.
Autorzy :
Li YH; Beijing Key Laboratory of Functional Materials for Building Structure and Environment Remediation, School of Environment and Energy Engineering, Beijing University of Civil Engineering and Architecture, Beijing, 100044, China.
Yi XH; Beijing Key Laboratory of Functional Materials for Building Structure and Environment Remediation, School of Environment and Energy Engineering, Beijing University of Civil Engineering and Architecture, Beijing, 100044, China.
Li YX; Beijing Key Laboratory of Functional Materials for Building Structure and Environment Remediation, School of Environment and Energy Engineering, Beijing University of Civil Engineering and Architecture, Beijing, 100044, China.
Wang CC; Beijing Key Laboratory of Functional Materials for Building Structure and Environment Remediation, School of Environment and Energy Engineering, Beijing University of Civil Engineering and Architecture, Beijing, 100044, China. Electronic address: .
Wang P; Beijing Key Laboratory of Functional Materials for Building Structure and Environment Remediation, School of Environment and Energy Engineering, Beijing University of Civil Engineering and Architecture, Beijing, 100044, China.
Zhao C; Beijing Key Laboratory of Functional Materials for Building Structure and Environment Remediation, School of Environment and Energy Engineering, Beijing University of Civil Engineering and Architecture, Beijing, 100044, China.
Zheng W; Department of Chemistry, Syracuse University, Syracuse, NY, 13244, United States.
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Źródło :
Environmental research [Environ Res] 2021 Oct; Vol. 201, pp. 111596. Date of Electronic Publication: 2021 Jul 02.
Typ publikacji :
Journal Article; Research Support, Non-U.S. Gov't
MeSH Terms :
Ligands*
Chromium ; Tartrates
Czasopismo naukowe
Tytuł :
Computational study on novel natural inhibitors targeting c-MET.
Autorzy :
Hou Y; Clinical College, Jilin University, Changchun, China.
Xie H; Clinical College, Jilin University, Changchun, China.
Dou G; Department of Breast Surgery, The First Bethune Hospital of Jilin University, Changchun, China.
Yang W; Clinical College, Jilin University, Changchun, China.
Ge J; Clinical College, Jilin University, Changchun, China.
Zhou B; Department of Gastroenterology, The First Affiliated Hospital of Xinxiang Medical College, Xinxiang, China.
Ren J; Clinical College, Jilin University, Changchun, China.
Li J; Clinical College, Jilin University, Changchun, China.
Wang J; Clinical College, Jilin University, Changchun, China.
Zhang Z; Clinical College, Jilin University, Changchun, China.
Wang X; Department of Oncology, First People's Hospital of Xinxiang, Xinxiang, China.
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Źródło :
Medicine [Medicine (Baltimore)] 2021 Sep 24; Vol. 100 (38), pp. e27171.
Typ publikacji :
Journal Article
MeSH Terms :
Ligands*
Proto-Oncogene Proteins c-met/*antagonists & inhibitors
Databases, Factual ; Drug Delivery Systems ; Drug Evaluation, Preclinical ; Humans ; Molecular Dynamics Simulation
Czasopismo naukowe
Tytuł :
RSV Promotes Epithelial Neuroendocrine Phenotype Differentiation through NODAL Signaling Pathway.
Autorzy :
Liu D; Department of Medical Microbiology, School of Basic Medical Sciences, Central South University, Changsha, 410078 Hunan, China.; China-Africa Research Center of Infectious Diseases, School of Basic Medical Sciences, Central South University, Changsha, 410078 Hunan, China.
Tang Z; Department of Medical Microbiology, School of Basic Medical Sciences, Central South University, Changsha, 410078 Hunan, China.
Qiu K; Department of Medical Microbiology, School of Basic Medical Sciences, Central South University, Changsha, 410078 Hunan, China.
Bajinka O; Department of Medical Microbiology, School of Basic Medical Sciences, Central South University, Changsha, 410078 Hunan, China.
Wang L; Department of Medical Microbiology, School of Basic Medical Sciences, Central South University, Changsha, 410078 Hunan, China.
Qin L; Department of Respiratory Medicine, Xiangya Hospital, Central South University, Changsha, 410078 Hunan, China.
Tan Y; Department of Medical Microbiology, School of Basic Medical Sciences, Central South University, Changsha, 410078 Hunan, China.; China-Africa Research Center of Infectious Diseases, School of Basic Medical Sciences, Central South University, Changsha, 410078 Hunan, China.
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Źródło :
BioMed research international [Biomed Res Int] 2021 Sep 08; Vol. 2021, pp. 9956078. Date of Electronic Publication: 2021 Sep 08 (Print Publication: 2021).
Typ publikacji :
Journal Article
MeSH Terms :
Neuroendocrine Cells/*metabolism
Nodal Signaling Ligands/*metabolism
Respiratory Syncytial Virus Infections/*physiopathology
Animals ; Asthma/metabolism ; Cell Differentiation ; Cell Line ; China ; Databases, Factual ; Databases, Genetic ; Disease Models, Animal ; Epithelial Cells/metabolism ; Epithelial Cells/virology ; Guinea Pigs ; HeLa Cells ; Humans ; Lung/metabolism ; Neuroendocrine Cells/virology ; Neuropeptides/metabolism ; Nodal Protein/genetics ; Nodal Protein/metabolism ; Nodal Protein/physiology ; Nodal Signaling Ligands/genetics ; Phenotype ; Respiratory Syncytial Virus Infections/metabolism ; Respiratory Syncytial Viruses/pathogenicity ; Signal Transduction
Czasopismo naukowe
Tytuł :
An updated classification and mechanistic insights into ligand binding of the substrate-binding proteins.
Autorzy :
Chandravanshi M; Department of Biosciences and Bioengineering, Indian Institute of Technology Guwahati, India.
Tripathi SK; Department of Biosciences and Bioengineering, Indian Institute of Technology Guwahati, India.
Kanaujia SP; Department of Biosciences and Bioengineering, Indian Institute of Technology Guwahati, India.
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Źródło :
FEBS letters [FEBS Lett] 2021 Sep; Vol. 595 (18), pp. 2395-2409. Date of Electronic Publication: 2021 Aug 20.
Typ publikacji :
Journal Article; Research Support, Non-U.S. Gov't
MeSH Terms :
Ligands*
Carrier Proteins/*classification
Carrier Proteins/*metabolism
Carrier Proteins/chemistry ; Databases, Protein ; Humans ; Models, Molecular ; Movement ; Protein Binding ; Protein Domains ; Protein Folding ; Substrate Specificity
Czasopismo naukowe
Tytuł :
Ligand-binding and -scavenging of the chemerin receptor GPR1.
Autorzy :
Fischer TF; Institute of Biochemistry, Leipzig University, Brüderstraße 34, 04103, Leipzig, Germany.
Czerniak AS; Institute of Biochemistry, Leipzig University, Brüderstraße 34, 04103, Leipzig, Germany.
Weiß T; Institute of Biochemistry, Leipzig University, Brüderstraße 34, 04103, Leipzig, Germany.
Schoeder CT; Center for Structural Biology, Department of Chemistry, Vanderbilt University, 465 21st Avenue South, Nashville, TN37212, USA.
Wolf P; Institute of Biochemistry, Leipzig University, Brüderstraße 34, 04103, Leipzig, Germany.
Seitz O; Department of Chemistry, Humboldt-Universität Zu Berlin, Brook-Taylor-Str. 2, 12489, Berlin, Germany.
Meiler J; Center for Structural Biology, Department of Chemistry, Vanderbilt University, 465 21st Avenue South, Nashville, TN37212, USA.; Institute for Drug Discovery, Leipzig University Medical School, 04103, Leipzig, Germany.
Beck-Sickinger AG; Institute of Biochemistry, Leipzig University, Brüderstraße 34, 04103, Leipzig, Germany. .
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Źródło :
Cellular and molecular life sciences : CMLS [Cell Mol Life Sci] 2021 Sep; Vol. 78 (17-18), pp. 6265-6281. Date of Electronic Publication: 2021 Jul 09.
Typ publikacji :
Journal Article
MeSH Terms :
Ligands*
Receptors, G-Protein-Coupled/*metabolism
Arrestins/metabolism ; Binding Sites ; Chemokines/chemistry ; Chemokines/metabolism ; Fluorescence Resonance Energy Transfer ; HEK293 Cells ; Humans ; Immunity, Innate ; Microscopy, Confocal ; Molecular Docking Simulation ; Mutagenesis ; Peptides/chemistry ; Peptides/metabolism ; Protein Binding ; Protein Structure, Tertiary ; Receptors, Chemokine/chemistry ; Receptors, Chemokine/metabolism ; Receptors, G-Protein-Coupled/chemistry ; Receptors, G-Protein-Coupled/genetics
Czasopismo naukowe
Tytuł :
Non-invasive determination of ionizable ligand group density on high internal phase emulsion derived polymer.
Autorzy :
Mravljak R; Faculty for Chemistry and Chemical Technology, University of Ljubljana, Večna pot 113, 1000 Ljubljana, Slovenia.
Bizjak O; Faculty for Chemistry and Chemical Technology, University of Ljubljana, Večna pot 113, 1000 Ljubljana, Slovenia.
Krajnc P; PolyOrgLab, Faculty for Chemistry and Chemical Engineering, University of Maribor, Smetanova 17, 2000 Maribor, Slovenia.
Paljevac M; PolyOrgLab, Faculty for Chemistry and Chemical Engineering, University of Maribor, Smetanova 17, 2000 Maribor, Slovenia.
Podgornik A; Faculty for Chemistry and Chemical Technology, University of Ljubljana, Večna pot 113, 1000 Ljubljana, Slovenia; COBIK, 5270 Ajdovščina, Slovenia. Electronic address: .
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Źródło :
Journal of chromatography. A [J Chromatogr A] 2021 Aug 30; Vol. 1652, pp. 462077. Date of Electronic Publication: 2021 Mar 18.
Typ publikacji :
Journal Article
MeSH Terms :
Chemistry Techniques, Analytical*/methods
Ligands*
Polymers*/chemistry
Buffers ; Chelating Agents/chemistry ; Chromatography, Liquid ; Emulsions/chemistry ; Hydrogen-Ion Concentration
Czasopismo naukowe
Tytuł :
Avidity and surface mobility in multivalent ligand-receptor binding.
Autorzy :
Merminod S; Martin A. Fisher School of Physics, Brandeis University, Waltham, MA 02453, USA. .
Edison JR
Fang H
Hagan MF
Rogers WB
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Źródło :
Nanoscale [Nanoscale] 2021 Aug 07; Vol. 13 (29), pp. 12602-12612. Date of Electronic Publication: 2021 Jul 14.
Typ publikacji :
Journal Article
MeSH Terms :
Ligands*
Binding Sites ; Cell Membrane/metabolism ; Protein Binding ; Thermodynamics
Czasopismo naukowe
Tytuł :
Detection of Alzheimer's disease-related neuroinflammation by a PET ligand selective for glial versus vascular translocator protein.
Autorzy :
Ji B; Department of Functional Brain Imaging Research, National Institute of Radiological Sciences, National Institutes for Quantum and Radiological Science and Technology, Chiba, Japan.
Ono M; Department of Functional Brain Imaging Research, National Institute of Radiological Sciences, National Institutes for Quantum and Radiological Science and Technology, Chiba, Japan.
Yamasaki T; Department of Radiopharmaceuticals Development, National Institute of Radiological Sciences, National Institutes for Quantum and Radiological Science and Technology, Chiba, Japan.
Fujinaga M; Department of Radiopharmaceuticals Development, National Institute of Radiological Sciences, National Institutes for Quantum and Radiological Science and Technology, Chiba, Japan.
Zhang MR; Department of Radiopharmaceuticals Development, National Institute of Radiological Sciences, National Institutes for Quantum and Radiological Science and Technology, Chiba, Japan.
Seki C; Department of Functional Brain Imaging Research, National Institute of Radiological Sciences, National Institutes for Quantum and Radiological Science and Technology, Chiba, Japan.
Aoki I; Department of Molecular Imaging and Theranostics, National Institute of Radiological Sciences, National Institutes for Quantum and Radiological Science and Technology, Chiba, Japan.
Kito S; Research, Development and Support Center, National Institute of Radiological Sciences, National Institutes for Quantum and Radiological Science and Technology, Chiba, Japan.
Sawada M; Department of Brain Function, Research Institute of Environmental Medicine, Nagoya University, Nagoya, Aichi, Japan.
Suhara T; Department of Functional Brain Imaging Research, National Institute of Radiological Sciences, National Institutes for Quantum and Radiological Science and Technology, Chiba, Japan.
Sahara N; Department of Functional Brain Imaging Research, National Institute of Radiological Sciences, National Institutes for Quantum and Radiological Science and Technology, Chiba, Japan.
Higuchi M; Department of Functional Brain Imaging Research, National Institute of Radiological Sciences, National Institutes for Quantum and Radiological Science and Technology, Chiba, Japan.
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Źródło :
Journal of cerebral blood flow and metabolism : official journal of the International Society of Cerebral Blood Flow and Metabolism [J Cereb Blood Flow Metab] 2021 Aug; Vol. 41 (8), pp. 2076-2089. Date of Electronic Publication: 2021 Feb 08.
Typ publikacji :
Journal Article; Research Support, Non-U.S. Gov't
MeSH Terms :
Ligands*
Alzheimer Disease/*pathology
Microglia/*metabolism
Receptors, GABA/*metabolism
Alzheimer Disease/diagnostic imaging ; Alzheimer Disease/metabolism ; Animals ; Brain/diagnostic imaging ; Brain/metabolism ; Brain/pathology ; Disease Models, Animal ; Hippocampus/metabolism ; Hippocampus/pathology ; Humans ; Magnetic Resonance Imaging ; Mice ; Mice, Inbred C57BL ; Mice, Transgenic ; Microglia/cytology ; Positron-Emission Tomography ; Radiopharmaceuticals/administration & dosage ; Radiopharmaceuticals/chemistry
Czasopismo naukowe
Tytuł :
Programmed cell death ligand-1 expression and survival in a cohort of patients with non-small cell lung cancer receiving first-line through third-line therapy in Denmark.
Autorzy :
Hedgeman E; EpidStrategies, Rockville, MD, USA. Electronic address: .
Nørgaard M; Department of Clinical Epidemiology, Aarhus University Hospital, Aarhus, Denmark. Electronic address: .
Dalvi T; AstraZeneca, Gaithersburg, MD, USA. Electronic address: .
Pedersen L; Department of Clinical Epidemiology, Aarhus University Hospital, Aarhus, Denmark. Electronic address: .
Hansen HP; Institute of Pathology, Aarhus University Hospital, Aarhus, Denmark. Electronic address: .
Walker J; AstraZeneca, Cambridge, United Kingdom. Electronic address: .
Midha A; AstraZeneca, Cambridge, United Kingdom. Electronic address: .
Shire N; AstraZeneca, Gaithersburg, MD, USA. Electronic address: .
Boothman AM; AstraZeneca, Cambridge, United Kingdom. Electronic address: .
Fryzek JP; EpidStrategies, Rockville, MD, USA; Department of Clinical Epidemiology, Aarhus University Hospital, Aarhus, Denmark. Electronic address: .
Rigas J; AstraZeneca, Gaithersburg, MD, USA. Electronic address: .
Mellemgaard A; Bornholms Hospital, Copenhagen, Denmark. Electronic address: .
Rasmussen TR; Danish Lung Cancer Group, Odense, Denmark; Department of Respiratory Medicine, Aarhus University Hospital, Aarhus, Denmark. Electronic address: .
Hamilton-Dutoit S; Institute of Pathology, Aarhus University Hospital, Aarhus, Denmark. Electronic address: .
Cronin-Fenton D; Department of Clinical Epidemiology, Aarhus University Hospital, Aarhus, Denmark. Electronic address: .
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Źródło :
Cancer epidemiology [Cancer Epidemiol] 2021 Aug; Vol. 73, pp. 101976. Date of Electronic Publication: 2021 Jul 01.
Typ publikacji :
Journal Article; Research Support, Non-U.S. Gov't
MeSH Terms :
Apoptosis*
Carcinoma, Non-Small-Cell Lung*/drug therapy
Carcinoma, Non-Small-Cell Lung*/mortality
Ligands*
Lung Neoplasms*/drug therapy
Adult ; Biomarkers, Tumor/metabolism ; Cohort Studies ; Denmark/epidemiology ; Humans ; Survival Analysis ; Treatment Outcome
Czasopismo naukowe
Tytuł :
Continuous Injection Isothermal Titration Calorimetry for In Situ Evaluation of Thermodynamic Binding Properties of Ligand-Receptor Binding Models.
Autorzy :
Chang JW; Department of Chemical Engineering, The Pennsylvania State University, University Park, Pennsylvania 16802, United States.; Department of Chemical Engineering, Kumoh National Institute of Technology, Gumi-si, Gyeongsangbuk-do 39177, South Korea.
Armaou A; Department of Chemical Engineering, The Pennsylvania State University, University Park, Pennsylvania 16802, United States.; Department of Mechanical Engineering, The Pennsylvania State University, University Park, Pennsylvania 16802, United States.; FORTH Institute of Chemical Engineering Sciences, Rio 26504, Greece.
Rioux RM; Department of Chemical Engineering, The Pennsylvania State University, University Park, Pennsylvania 16802, United States.; Department of Chemistry, The Pennsylvania State University, University Park, Pennsylvania 16802, United States.
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Źródło :
The journal of physical chemistry. B [J Phys Chem B] 2021 Jul 29; Vol. 125 (29), pp. 8075-8087. Date of Electronic Publication: 2021 Jul 14.
Typ publikacji :
Journal Article; Research Support, U.S. Gov't, Non-P.H.S.
MeSH Terms :
Ligands*
Biophysical Phenomena ; Calorimetry ; Protein Binding ; Thermodynamics
Czasopismo naukowe
Tytuł :
What's in a name? From "fluctuation fit" to "conformational selection": rediscovery of a concept.
Autorzy :
Orosz F; Institute of Enzymology, Research Centre for Natural Sciences, Magyar tudósok körútja 2, Budapest, 1117, Hungary. .
Vértessy BG; Institute of Enzymology, Research Centre for Natural Sciences, Magyar tudósok körútja 2, Budapest, 1117, Hungary.; Department of Applied Biotechnology and Food Sciences, Budapest University of Technology and Economics, Budapest, 1111, Hungary.
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Źródło :
History and philosophy of the life sciences [Hist Philos Life Sci] 2021 Jul 09; Vol. 43 (3), pp. 88. Date of Electronic Publication: 2021 Jul 09.
Typ publikacji :
Historical Article; Journal Article
MeSH Terms :
Ligands*
Terminology as Topic*
Biochemistry/*history
Proteins/*chemistry
History, 20th Century ; History, 21st Century
Czasopismo naukowe
Tytuł :
Synthesis and evaluation of multi-target-directed ligands with BACE-1 inhibitory and Nrf2 agonist activities as potential agents against Alzheimer's disease.
Autorzy :
Qu L; Jiangsu Key Laboratory of Bioactive Natural Product Research and State Key Laboratory of Natural Medicines, Department of Natural Medicinal Chemistry, School of Traditional Chinese Pharmacy, China Pharmaceutical University, Nanjing, 210009, China.
Ji L; Jiangsu Key Laboratory of Bioactive Natural Product Research and State Key Laboratory of Natural Medicines, Department of Natural Medicinal Chemistry, School of Traditional Chinese Pharmacy, China Pharmaceutical University, Nanjing, 210009, China.
Wang C; Jiangsu Key Laboratory of Bioactive Natural Product Research and State Key Laboratory of Natural Medicines, Department of Natural Medicinal Chemistry, School of Traditional Chinese Pharmacy, China Pharmaceutical University, Nanjing, 210009, China.
Luo H; Jiangsu Key Laboratory of Bioactive Natural Product Research and State Key Laboratory of Natural Medicines, Department of Natural Medicinal Chemistry, School of Traditional Chinese Pharmacy, China Pharmaceutical University, Nanjing, 210009, China.
Li S; Jiangsu Key Laboratory of Bioactive Natural Product Research and State Key Laboratory of Natural Medicines, Department of Natural Medicinal Chemistry, School of Traditional Chinese Pharmacy, China Pharmaceutical University, Nanjing, 210009, China.
Peng W; Jiangsu Key Laboratory of Bioactive Natural Product Research and State Key Laboratory of Natural Medicines, Department of Natural Medicinal Chemistry, School of Traditional Chinese Pharmacy, China Pharmaceutical University, Nanjing, 210009, China.
Yin F; Jiangsu Key Laboratory of Bioactive Natural Product Research and State Key Laboratory of Natural Medicines, Department of Natural Medicinal Chemistry, School of Traditional Chinese Pharmacy, China Pharmaceutical University, Nanjing, 210009, China.
Lu D; Jiangsu Key Laboratory of Bioactive Natural Product Research and State Key Laboratory of Natural Medicines, Department of Natural Medicinal Chemistry, School of Traditional Chinese Pharmacy, China Pharmaceutical University, Nanjing, 210009, China.
Liu X; Jiangsu Key Laboratory of Bioactive Natural Product Research and State Key Laboratory of Natural Medicines, Department of Natural Medicinal Chemistry, School of Traditional Chinese Pharmacy, China Pharmaceutical University, Nanjing, 210009, China.
Kong L; Jiangsu Key Laboratory of Bioactive Natural Product Research and State Key Laboratory of Natural Medicines, Department of Natural Medicinal Chemistry, School of Traditional Chinese Pharmacy, China Pharmaceutical University, Nanjing, 210009, China. Electronic address: .
Wang X; Jiangsu Key Laboratory of Bioactive Natural Product Research and State Key Laboratory of Natural Medicines, Department of Natural Medicinal Chemistry, School of Traditional Chinese Pharmacy, China Pharmaceutical University, Nanjing, 210009, China. Electronic address: .
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Źródło :
European journal of medicinal chemistry [Eur J Med Chem] 2021 Jul 05; Vol. 219, pp. 113441. Date of Electronic Publication: 2021 Apr 07.
Typ publikacji :
Journal Article
MeSH Terms :
Ligands*
Amyloid Precursor Protein Secretases/*antagonists & inhibitors
Aspartic Acid Endopeptidases/*antagonists & inhibitors
NF-E2-Related Factor 2/*antagonists & inhibitors
Neuroprotective Agents/*chemical synthesis
Alzheimer Disease/drug therapy ; Amyloid Precursor Protein Secretases/metabolism ; Amyloid beta-Peptides/metabolism ; Antioxidants/metabolism ; Aspartic Acid Endopeptidases/metabolism ; Azoles/chemistry ; Azoles/metabolism ; Azoles/pharmacology ; Azoles/therapeutic use ; Binding Sites ; Blood-Brain Barrier/drug effects ; Blood-Brain Barrier/metabolism ; Cyclic S-Oxides/chemistry ; Cyclic S-Oxides/metabolism ; Cyclic S-Oxides/pharmacology ; Cyclic S-Oxides/therapeutic use ; Drug Design ; Humans ; Interleukin-6/metabolism ; Mitochondria/drug effects ; Mitochondria/metabolism ; Molecular Docking Simulation ; NF-E2-Related Factor 2/metabolism ; Neuroprotective Agents/metabolism ; Neuroprotective Agents/pharmacology ; Neuroprotective Agents/therapeutic use ; Organoselenium Compounds/chemistry ; Organoselenium Compounds/metabolism ; Organoselenium Compounds/pharmacology ; Organoselenium Compounds/therapeutic use ; Oxidative Stress/drug effects ; Peptide Fragments/metabolism ; Reactive Oxygen Species/metabolism ; Selenium/chemistry ; Signal Transduction/drug effects ; Thiadiazines/chemistry ; Thiadiazines/metabolism ; Thiadiazines/pharmacology ; Thiadiazines/therapeutic use
Czasopismo naukowe
Tytuł :
Development of MDM2 degraders based on ligands derived from Ugi reactions: Lessons and discoveries.
Autorzy :
Wang B; School of Pharmacy, University of Wisconsin-Madison, Madison, WI, 53705, USA.
Liu J; School of Pharmacy, University of Wisconsin-Madison, Madison, WI, 53705, USA.
Tandon I; School of Pharmacy, University of Wisconsin-Madison, Madison, WI, 53705, USA; Molecular and Cellular Pharmacology Training Program, University of Wisconsin-Madison, Madison, WI 53705, USA.
Wu S; School of Pharmacy, University of Wisconsin-Madison, Madison, WI, 53705, USA.
Teng P; School of Pharmacy, University of Wisconsin-Madison, Madison, WI, 53705, USA.
Liao J; School of Pharmacy, University of Wisconsin-Madison, Madison, WI, 53705, USA.
Tang W; School of Pharmacy, University of Wisconsin-Madison, Madison, WI, 53705, USA; Department of Chemistry, University of Wisconsin-Madison, Madison, WI, 53705, USA. Electronic address: .
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Źródło :
European journal of medicinal chemistry [Eur J Med Chem] 2021 Jul 05; Vol. 219, pp. 113425. Date of Electronic Publication: 2021 Apr 04.
Typ publikacji :
Journal Article
MeSH Terms :
Ligands*
Proto-Oncogene Proteins c-mdm2/*metabolism
Cell Line, Tumor ; Cell Proliferation/drug effects ; Cell Survival/drug effects ; Drug Design ; Humans ; Indoles/chemical synthesis ; Indoles/chemistry ; Indoles/pharmacology ; Protein Binding ; Proteolysis ; Structure-Activity Relationship ; Tumor Suppressor Protein p53/metabolism
Czasopismo naukowe
Tytuł :
Recognizing and validating ligands with CheckMyBlob.
Autorzy :
Brzezinski D; Department of Molecular Physiology and Biological Physics, University of Virginia, Charlottesville, VA 22908, USA.; Institute of Computing Science, Poznan University of Technology, Poznan, 60-965, Poland.; Center for Biocrystallographic Research, Institute of Bioorganic Chemistry, Polish Academy of Sciences, Poznan, 61-704, Poland.
Porebski PJ; Department of Molecular Physiology and Biological Physics, University of Virginia, Charlottesville, VA 22908, USA.
Kowiel M; Center for Biocrystallographic Research, Institute of Bioorganic Chemistry, Polish Academy of Sciences, Poznan, 61-704, Poland.
Macnar JM; Department of Molecular Physiology and Biological Physics, University of Virginia, Charlottesville, VA 22908, USA.; College of Inter-Faculty Individual Studies in Mathematics and Natural Sciences, University of Warsaw, Warsaw, 02-097, Poland.; Faculty of Chemistry, Biological and Chemical Research Center, University of Warsaw, Warsaw, 02-089, Poland.
Minor W; Department of Molecular Physiology and Biological Physics, University of Virginia, Charlottesville, VA 22908, USA.
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Źródło :
Nucleic acids research [Nucleic Acids Res] 2021 Jul 02; Vol. 49 (W1), pp. W86-W92.
Typ publikacji :
Journal Article; Research Support, N.I.H., Extramural; Research Support, Non-U.S. Gov't
MeSH Terms :
Ligands*
Software*
Cluster Analysis ; Crystallography ; Databases, Protein ; Machine Learning ; Metals/chemistry ; Peptides/chemistry ; Water/chemistry
Czasopismo naukowe
Tytuł :
' All That Glitters Is Not Gold ': High-Resolution Crystal Structures of Ligand-Protein Complexes Need Not Always Represent Confident Binding Poses.
Autorzy :
Chakraborti S; Molecular Biophysics Unit, Indian Institute of Science, Bengaluru 560012, Karnataka, India.
Hatti K; Wellcome Centre for Anti-Infectives Research, Drug Discovery Unit, School of Life Sciences, University of Dundee, Dow Street, Dundee DDI 5EH, UK.
Srinivasan N; Molecular Biophysics Unit, Indian Institute of Science, Bengaluru 560012, Karnataka, India.
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Źródło :
International journal of molecular sciences [Int J Mol Sci] 2021 Jun 25; Vol. 22 (13). Date of Electronic Publication: 2021 Jun 25.
Typ publikacji :
Journal Article
MeSH Terms :
Binding Sites*
Ligands*
Models, Molecular*
Macromolecular Substances/*chemistry
Proteins/*chemistry
Crystallography, X-Ray ; Macromolecular Substances/metabolism ; Molecular Conformation ; Protein Binding ; Proteins/metabolism
Czasopismo naukowe
Tytuł :
The Good, the Bad, and the Twisted Revisited: An Analysis of Ligand Geometry in Highly Resolved Protein-Ligand X-ray Structures.
Autorzy :
Liebeschuetz JW; Skilos Chemoinformatics, 159 Water Street, Cambridge CB4 1PB, United Kingdom.; Astex Pharmaceuticals, 436 Cambridge Science Park, Milton Road, Milton, Cambridge CB4 0QA, United Kingdom.
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Źródło :
Journal of medicinal chemistry [J Med Chem] 2021 Jun 10; Vol. 64 (11), pp. 7533-7543. Date of Electronic Publication: 2021 Jun 01.
Typ publikacji :
Journal Article
MeSH Terms :
Ligands*
Proteins/*chemistry
Crystallography, X-Ray ; Density Functional Theory ; Models, Theoretical ; Proteins/metabolism ; Substrate Specificity ; Thermodynamics ; Ubiquitin-Activating Enzymes/chemistry ; Ubiquitin-Activating Enzymes/metabolism
Czasopismo naukowe
Tytuł :
Novel Dual-Target μ-Opioid Receptor and Dopamine D 3 Receptor Ligands as Potential Nonaddictive Pharmacotherapeutics for Pain Management.
Autorzy :
Bonifazi A; Medicinal Chemistry Section, Molecular Targets and Medications Discovery Branch, National Institute on Drug Abuse-Intramural Research Program, National Institutes of Health, 333 Cassell Drive, Baltimore, Maryland 21224, United States.
Battiti FO; Medicinal Chemistry Section, Molecular Targets and Medications Discovery Branch, National Institute on Drug Abuse-Intramural Research Program, National Institutes of Health, 333 Cassell Drive, Baltimore, Maryland 21224, United States.
Sanchez J; Division of Physiology, Pharmacology and Neuroscience, School of Life Sciences, Queen's Medical Centre, University of Nottingham, Nottingham NG7 2UH, U.K.; Centre of Membrane Protein and Receptors, Universities of Birmingham and Nottingham, Midlands NG2 7AG, U.K.
Zaidi SA; Bridge Institute, Michelson Center for Convergent Bioscience, Department of Chemistry, Department of Biological Sciences, University of Southern California, Los Angeles, California 90089, United States.
Bow E; Drug Design and Synthesis Section, Molecular Targets and Medications Discovery Branch, National Institute on Drug Abuse-Intramural Research Program, National Institutes of Health, 9800 Medical Center Drive, Bethesda, Maryland 20892, United States.
Makarova M; Drug Design and Synthesis Section, Molecular Targets and Medications Discovery Branch, National Institute on Drug Abuse-Intramural Research Program, National Institutes of Health, 9800 Medical Center Drive, Bethesda, Maryland 20892, United States.
Cao J; Medicinal Chemistry Section, Molecular Targets and Medications Discovery Branch, National Institute on Drug Abuse-Intramural Research Program, National Institutes of Health, 333 Cassell Drive, Baltimore, Maryland 21224, United States.
Shaik AB; Medicinal Chemistry Section, Molecular Targets and Medications Discovery Branch, National Institute on Drug Abuse-Intramural Research Program, National Institutes of Health, 333 Cassell Drive, Baltimore, Maryland 21224, United States.
Sulima A; Drug Design and Synthesis Section, Molecular Targets and Medications Discovery Branch, National Institute on Drug Abuse-Intramural Research Program, National Institutes of Health, 9800 Medical Center Drive, Bethesda, Maryland 20892, United States.
Rice KC; Drug Design and Synthesis Section, Molecular Targets and Medications Discovery Branch, National Institute on Drug Abuse-Intramural Research Program, National Institutes of Health, 9800 Medical Center Drive, Bethesda, Maryland 20892, United States.
Katritch V; Bridge Institute, Michelson Center for Convergent Bioscience, Department of Chemistry, Department of Biological Sciences, University of Southern California, Los Angeles, California 90089, United States.
Canals M; Division of Physiology, Pharmacology and Neuroscience, School of Life Sciences, Queen's Medical Centre, University of Nottingham, Nottingham NG7 2UH, U.K.; Centre of Membrane Protein and Receptors, Universities of Birmingham and Nottingham, Midlands NG2 7AG, U.K.
Lane JR; Division of Physiology, Pharmacology and Neuroscience, School of Life Sciences, Queen's Medical Centre, University of Nottingham, Nottingham NG7 2UH, U.K.; Centre of Membrane Protein and Receptors, Universities of Birmingham and Nottingham, Midlands NG2 7AG, U.K.
Newman AH; Medicinal Chemistry Section, Molecular Targets and Medications Discovery Branch, National Institute on Drug Abuse-Intramural Research Program, National Institutes of Health, 333 Cassell Drive, Baltimore, Maryland 21224, United States.
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Źródło :
Journal of medicinal chemistry [J Med Chem] 2021 Jun 10; Vol. 64 (11), pp. 7778-7808. Date of Electronic Publication: 2021 May 20.
Typ publikacji :
Journal Article; Research Support, N.I.H., Extramural; Research Support, N.I.H., Intramural
MeSH Terms :
Ligands*
Dopamine Antagonists/*chemistry
Receptors, Dopamine D3/*metabolism
Receptors, Opioid, mu/*metabolism
Analgesics, Opioid/therapeutic use ; Animals ; Binding Sites ; Biphenyl Compounds/chemistry ; Biphenyl Compounds/metabolism ; Biphenyl Compounds/therapeutic use ; Disease Models, Animal ; Dopamine Antagonists/metabolism ; Dopamine Antagonists/therapeutic use ; Drug Design ; Fluorescence Resonance Energy Transfer ; Mice ; Molecular Docking Simulation ; Opioid-Related Disorders/drug therapy ; Pain/drug therapy ; Pain Management ; Receptors, Dopamine D3/agonists ; Receptors, Dopamine D3/antagonists & inhibitors ; Receptors, Opioid, mu/agonists ; Structure-Activity Relationship
Czasopismo naukowe

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