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Electrochemical conversion of organic compounds and inorganic small molecules
Electrochemical synthesis presents a facile and sustainable strategy to produce valuable molecules. This review summarizes the most recent advances...
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Targeting RNA with Small Molecules
Ribonucleic acid (RNA) is a key regulator of many biological processes including translation, gene expression, gene splicing, developmental timing,...
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Targeting RNA with Small Molecules
Ribonucleic acid (RNA) is a key regulator of many biological processes including translation, gene expression, gene splicing, developmental timing,...
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Small Molecules Targeting Repeat Sequences Causing Neurological Disorders
Expansion of specific repeat sequences in human genomic DNA causes neurological disorders if the expanded repeats exceed a certain threshold....
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DNA-encoded library-enabled discovery of proximity-inducing small molecules
Small molecules that induce protein–protein associations represent powerful tools to modulate cell circuitry. We sought to develop a platform for the...
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A common mechanism of Sec61 translocon inhibition by small molecules
The Sec61 complex forms a protein-conducting channel in the endoplasmic reticulum membrane that is required for secretion of soluble proteins and...
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Remodeling oncogenic transcriptomes by small molecules targeting NONO
Much of the human proteome is involved in mRNA homeostasis, but most RNA-binding proteins lack chemical probes. Here we identify electrophilic small...
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Tetrakis(benzoxazine) calix[4]resorcinarenes as hosts for small molecules
Tetrakis(l,3-dihydrobenzoxazine) calix[4]resorcinarenes 4 – 6 were synthesized via the Mannich reaction from the corresponding resorcin[4]arenes 1 – 3 ...
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Target identification of small molecules: an overview of the current applications in drug discovery
Target identification is an essential part of the drug discovery and development process, and its efficacy plays a crucial role in the success of any...
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PDBe CCDUtils: an RDKit-based toolkit for handling and analysing small molecules in the Protein Data Bank
While the Protein Data Bank (PDB) contains a wealth of structural information on ligands bound to macromolecules, their analysis can be challenging...
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Theoretical design and evaluation of efficient small donor molecules for organic solar cells
ContextThe development of high-efficiency photovoltaic devices is the need of time with increasing demand for energy. Herein, we designed seven small...
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ProfhEX: AI-based platform for small molecules liability profiling
Off-target drug interactions are a major reason for candidate failure in the drug discovery process. Anticipating potential drug’s adverse effects in...
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Tackling assay interference associated with small molecules
Biochemical and cell-based assays are essential to discovering and optimizing efficacious and safe drugs, agrochemicals and cosmetics. However, false...
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Targeting DNA Junctions with Small Molecules for Therapeutic Applications in Oncology
DNA junctions exist at the branch point of three or four DNA duplexes (dsDNA or B DNA) in hairpin and cruciform structures. These structures occur...
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Controlling anisotropic properties by manipulating the orientation of chiral small molecules
Chiral π -conjugated molecules bring new functionality to technological applications and represent an exciting, rapidly expanding area of research....
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Small Molecules Targeting Repeat Sequences Causing Neurological Disorders
Expansion of specific repeat sequences in human genomic DNA causes neurological disorders if the expanded repeats exceed a certain threshold....
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The Cluster Approach for the Adsorption of Small Molecules on Oxide Surfaces
The correct description of the weak interaction between small molecules and oxide surfaces is still a challenge for theory. In the present review,...
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Minimizing higher-order aggregation maximizes iron mobilization by small molecules
The natural product hinokitiol mobilizes iron across lipid bilayers at low concentrations and restores hemoglobinization in iron transporter...
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Improved docking of peptides and small molecules in iMOLSDOCK
iMOLSDOCK is an induced-fit docking algorithm that uses the mutually orthogonal Latin squares (MOLS) sampling technique. Here, we describe the...
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Rapid induction of dopaminergic neuron-like cells from human fibroblasts by autophagy activation with only 2-small molecules
The dopaminergic neurons are responsible for the release of dopamine. Several diseases that affect motor function, including Parkinson's disease...
