One Scaffold, Three Binding Modes: Novel and Selective Pteridine Reductase 1 Inhibitors Derived from Fragment Hits Discovered by Virtual Screening
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Recent developments in drug discovery for leishmaniasis and human African trypanosomiasisDevelopment and validation of a cytochrome c-coupled assay for pteridine reductase 1 and dihydrofolate reductaseStructure-Based Design of Pteridine Reductase Inhibitors Targeting African Sleeping Sickness and the LeishmaniasesHigh-resolution structures ofTrypanosoma bruceipteridine reductase ligand complexes inform on the placement of new molecular entities in the active site of a potential drug targetStructure of recombinantLeishmania donovanipteridine reductase reveals a disordered active siteNovel Ligands for a Purine Riboswitch Discovered by RNA-Ligand DockingCrystallographic analysis reveals a novel second binding site for trimethoprim in active site double mutants of human dihydrofolate reductaseDe Novo Design of Protein Kinase Inhibitors by in Silico Identification of Hinge Region-Binding FragmentsThe benzimidazole based drugs show good activity against T. gondii but poor activity against its proposed enoyl reductase enzyme targetStructure-Based Design and Synthesis of Antiparasitic Pyrrolopyrimidines Targeting Pteridine Reductase 1Tracing binding modes in hit-to-lead optimization: chameleon-like poses of aspartic protease inhibitorsThe Potential of Secondary Metabolites from Plants as Drugs or Leads against Protozoan Neglected Diseases-Part III: In-Silico Molecular Docking InvestigationsIspE inhibitors identified by a combination of in silico and in vitro high-throughput screeningLigand pose and orientational sampling in molecular dockingDocking Screens for Novel Ligands Conferring New Biology.Virtual fragment screening for novel inhibitors of 6-phosphogluconate dehydrogenase.Fragment screening of infectious disease targets in a structural genomics environmentEssential multimeric enzymes in kinetoplastid parasites: A host of potentially druggable protein-protein interactions.Trypanosoma brucei pteridine reductase 1 is essential for survival in vitro and for virulence in miceDesign, synthesis and biological evaluation of novel inhibitors of Trypanosoma brucei pteridine reductase 1.Library of Seleno-Compounds as Novel Agents against Leishmania Species.Fragment-based drug discovery as alternative strategy to the drug development for neglected diseases.State of the art in African trypanosome drug discovery.Computational medicinal chemistry in fragment-based drug discovery: what, how and when.Drug discovery for neglected diseases: molecular target-based and phenotypic approaches.Discovery of triazine mimetics as potent antileishmanial agents.Structure- and ligand-based virtual screening identifies new scaffolds for inhibitors of the oncoprotein MDM2.Application of a simple quantum chemical approach to ligand fragment scoring for Trypanosoma brucei pteridine reductase 1 inhibition.Screening a Natural Product-Based Library against Kinetoplastid Parasites.Pharmacophore Mapping, In Silico Screening and Molecular Docking to Identify Selective Trypanosoma brucei Pteridine Reductase Inhibitors.Chroman-4-One Derivatives Targeting Pteridine Reductase 1 and Showing Anti-Parasitic Activity.3D-QSAR based pharmacophore modeling and virtual screening for identification of novel pteridine reductase inhibitors.Development of Chemical Proteomics for the Folateome and Analysis of the Kinetoplastid Folateome
P2860
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P2860
One Scaffold, Three Binding Modes: Novel and Selective Pteridine Reductase 1 Inhibitors Derived from Fragment Hits Discovered by Virtual Screening
description
2009 nî lūn-bûn
@nan
2009 թուականի Յուլիսին հրատարակուած գիտական յօդուած
@hyw
2009 թվականի հուլիսին հրատարակված գիտական հոդված
@hy
2009年の論文
@ja
2009年論文
@yue
2009年論文
@zh-hant
2009年論文
@zh-hk
2009年論文
@zh-mo
2009年論文
@zh-tw
2009年论文
@wuu
name
One Scaffold, Three Binding Mo ...... iscovered by Virtual Screening
@ast
One Scaffold, Three Binding Mo ...... iscovered by Virtual Screening
@en
One Scaffold, Three Binding Mo ...... iscovered by Virtual Screening
@nl
type
label
One Scaffold, Three Binding Mo ...... iscovered by Virtual Screening
@ast
One Scaffold, Three Binding Mo ...... iscovered by Virtual Screening
@en
One Scaffold, Three Binding Mo ...... iscovered by Virtual Screening
@nl
prefLabel
One Scaffold, Three Binding Mo ...... iscovered by Virtual Screening
@ast
One Scaffold, Three Binding Mo ...... iscovered by Virtual Screening
@en
One Scaffold, Three Binding Mo ...... iscovered by Virtual Screening
@nl
P2093
P2860
P50
P356
P1476
One Scaffold, Three Binding Mo ...... iscovered by Virtual Screening
@en
P2093
Chidochangu P Mpamhanga
Daniel Spinks
Iain T Collie
Julie A Frearson
William N Hunter
P2860
P304
P356
10.1021/JM900414X
P407
P577
2009-07-23T00:00:00Z