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Locating Sweet Spots for Screening Hits and Evaluating Pan-Assay Interference Filters from the Performance Analysis of Two Lead-like Libraries

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What this work says

Outgoing claims: the papers this work cites, builds on, or argues with.

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Lead‐Oriented Synthesis: A New Opportunity for Synthetic Chemistry

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Lessons Learnt from Assembling Screening Libraries for Drug Discovery for Neglected Diseases

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Identification of Inhibitors of the Leishmania cdc2‐Related Protein Kinase CRK3

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The picornaviral 3C proteinases: Cysteine nucleophiles in serine proteinase folds

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The Design, Annotation, and Application of a Kinase-Targeted Library

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Apparent activity in high-throughput screening: origins of compound-dependent assay interference

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Hsp90 is essential in the filarial nematode Brugia pahangi

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Experiences in fragment-based drug discovery

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Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings 1PII of original article: S0169-409X(96)00423-1. The article was originally published in Advanced Drug Delivery Reviews 23 (1997) 3–25. 1

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Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings

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Ligand efficiency: a useful metric for lead selection

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Molecular Complexity and Its Impact on the Probability of Finding Leads for Drug Discovery

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Is There a Difference between Leads and Drugs? A Historical Perspective

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Relationships between Molecular Complexity, Biological Activity, and Structural Diversity

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Mining the ChEMBL Database: An Efficient Chemoinformatics Workflow for Assembling an Ion Channel-Focused Screening Library

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Computational Analysis of Human OGA Structure in Complex with PUGNAc and NAG-Thiazoline Derivatives

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Chemical and Biological Properties of Frequent Screening Hits

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Virtual Exploration of the Chemical Universe up to 11 Atoms of C, N, O, F: Assembly of 26.4 Million Structures (110.9 Million Stereoisomers) and Analysis for New Ring Systems, Stereochemistry, Physicochemical Properties, Compound Classes, and Drug Discovery

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Enhanced HTS Hit Selection via a Local Hit Rate Analysis

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ALARM NMR: A Rapid and Robust Experimental Method To Detect Reactive False Positives in Biochemical Screens

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Interpreting Steep Dose-Response Curves in Early Inhibitor Discovery

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Trends in Kinase Selectivity: Insights for Target Class-Focused Library Screening

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Discovery of a Novel Class of Orally Active Trypanocidal N-Myristoyltransferase Inhibitors

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New Substructure Filters for Removal of Pan Assay Interference Compounds (PAINS) from Screening Libraries and for Their Exclusion in Bioassays

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Escape from Flatland: Increasing Saturation as an Approach to Improving Clinical Success

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N-myristoyltransferase inhibitors as new leads to treat sleeping sickness

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Structure of human O-GlcNAc transferase and its complex with a peptide substrate

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Grand Challenge Commentary: Accessing new chemical space for 'undruggable' targets

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Impact of high-throughput screening in biomedical research

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The influence of the 'organizational factor' on compound quality in drug discovery

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The maximal affinity of ligands

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Chemical Validation of Trypanothione Synthetase

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Nuclear DBF-2-related Kinases Are Essential Regulators of Cytokinesis in Bloodstream Stage Trypanosoma brucei

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The Synthesis of UDP-N-acetylglucosamine Is Essential for Bloodstream Form Trypanosoma brucei in Vitro and in Vivo and UDP-N-acetylglucosamine Starvation Reveals a Hierarchy in Parasite Protein Glycosylation

inferredcites →https://doi.org/10.1111/j.1365-2958.2007.05866.xopenalex-snapshot

Trypanosoma brucei Polo‐like kinase is essential for basal body duplication, kDNA segregation and cytokinesis

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A Plant-Like Kinase in Plasmodium falciparum Regulates Parasite Egress from Erythrocytes

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Glycogen Synthase Kinase 3 Is a Potential Drug Target for African Trypanosomiasis Therapy

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A Simple Statistical Parameter for Use in Evaluation and Validation of High Throughput Screening Assays

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IspE Inhibitors Identified by a Combination of In Silico and In Vitro High-Throughput Screening

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False Positives in the Early Stages of Drug Discovery

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Analysing the Output from Primary Screening

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Recent Developments in Focused Library Design: Targeting Gene-Families

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