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The necessary nitrogen atom: a versatile high-impact design element for multiparameter optimization
LD Pennington, DT Moustakas - Journal of Medicinal Chemistry, 2017 - ACS Publications
There is a continued desire in biomedical research to reduce the number and duration of
design cycles required to optimize lead compounds into high-quality chemical probes or …
design cycles required to optimize lead compounds into high-quality chemical probes or …
Practical strategies and concepts in GPCR allosteric modulator discovery: recent advances with metabotropic glutamate receptors
Allosteric modulation of GPCRs has initiated a new era of basic and translational discovery,
filled with therapeutic promise yet fraught with caveats. Allosteric ligands stabilize unique …
filled with therapeutic promise yet fraught with caveats. Allosteric ligands stabilize unique …
Leveraging language model for advanced multiproperty molecular optimization via prompt engineering
Optimizing a candidate molecule's physiochemical and functional properties has been a
critical task in drug and material design. Although the non-trivial task of balancing multiple …
critical task in drug and material design. Although the non-trivial task of balancing multiple …
Electrochemical synthesis of 1, 2, 4-triazole-fused heterocycles
Z Ye, M Ding, Y Wu, Y Li, W Hua, F Zhang - Green chemistry, 2018 - pubs.rsc.org
A reagent-free intramolecular dehydrogenative C–N cross-coupling reaction has been
developed under mild electrolytic conditions. In this atom-and step-economical one-pot …
developed under mild electrolytic conditions. In this atom-and step-economical one-pot …
International union of basic and clinical pharmacology. CXI. Pharmacology, signaling, and physiology of metabotropic glutamate receptors
Metabotropic glutamate (mGlu) receptors respond to glutamate, the major excitatory
neurotransmitter in the mammalian brain, mediating a modulatory role that is critical for …
neurotransmitter in the mammalian brain, mediating a modulatory role that is critical for …
Synthesis, crystal structure, herbicidal activities and 3D‐QSAR study of some novel 1,2,4‐triazolo[4,3‐a]pyridine derivatives
XH Liu, XY Xu, CX Tan, JQ Weng… - Pest Management …, 2015 - Wiley Online Library
Abstract BACKGROUND 1, 2, 4‐Triazolo [4, 3‐a] pyridine derivatives represent a new series
of compounds that possess good herbicidal activity against Echinochloa crusgalli (L.) …
of compounds that possess good herbicidal activity against Echinochloa crusgalli (L.) …
Visible‐Light‐Induced nickel‐catalyzed negishi cross‐couplings by exogenous‐photosensitizer‐free photocatalysis
The merging of photoredox and transition‐metal catalysis has become one of the most
attractive approaches for carbon–carbon bond formation. Such reactions require the use of …
attractive approaches for carbon–carbon bond formation. Such reactions require the use of …
Pyridines and Imidazopyridines with medicinal significance
T LS Kishbaugh - Current Topics in Medicinal Chemistry, 2016 - ingentaconnect.com
Pyridine and pyridine-fused ring systems are ubiquitous in medicinal research and
demonstrate such diverse pharmacological benefits as anticonvulsant therapies, treatment …
demonstrate such diverse pharmacological benefits as anticonvulsant therapies, treatment …
Scaffold-hop** as a strategy to address metabolic liabilities of aromatic compounds
PR Lazzara, TW Moore - RSC Medicinal Chemistry, 2020 - pubs.rsc.org
Understanding and minimizing oxidative metabolism of aromatic compounds is a key hurdle
in lead optimization. Metabolic processes not only clear compounds from the body, but they …
in lead optimization. Metabolic processes not only clear compounds from the body, but they …
Conformational fingerprinting of allosteric modulators in metabotropic glutamate receptor 2
BWH Liauw, A Foroutan, MR Schamber, W Lu… - Elife, 2022 - elifesciences.org
Activation of G protein-coupled receptors (GPCRs) is an allosteric process. It involves
conformational coupling between the orthosteric ligand binding site and the G protein …
conformational coupling between the orthosteric ligand binding site and the G protein …