Results 151 to 160 of about 26,232 (247)

In silico pipeline for GSK 3β inhibitor discovery in Alzheimer's disease using pharmacophore screening, docking, ADME filtering, and MD validation. [PDF]

Sci Rep
Elkotamy MS, Elgohary MK, Alkotami AS, Eldesouki MM, Elsayed ZM, Mattar AA, Abo-Ashour MF, Tawfik HO, Eldehna WM, Abdel-Aziz HA.   +9 more
europepmc   +1 more source

Supramolecular Behaviour of Heterochiral Dipeptides With Ile

Journal of Peptide Science, Volume 32, Issue 10, October 2026.
This study describes the supramolecular behaviour and gelation of heterochiral, aliphatic dipeptides d‐Ile‐l‐Xaa (Xaa = Ala, Val, Leu or Ile) in various solvents and buffered water at neutral pH. Metastable gels rapidly crystallised. X‐ray diffraction analysis was conducted to unveil the dipeptides' packing modes in amphipathic layers.
Erica Scarel, Paola Alletto, Simone Adorinni, Fabio Fazio, Giovanni Pierri, Consiglia Tedesco, Silvia Marchesan   +6 more
wiley   +1 more source

Bicyclo[1.1.1]pentane as a Phenyl Isosteric Replacement. [PDF]

ACS Med Chem Lett
Saar A, Kombo DC, Thurairatnam S, Kothe M, Merriman G, Tsymbal AV, Kane JL, LaMarche MJ, Gkeka P, Li Y.   +9 more
europepmc   +1 more source

Piper nigrum Has an Antitumor Effect Through Regulation of the Phosphatidylinositol 3‐Kinase Signaling Pathway in a Murine Model of Acute Myeloid Leukemia

Phytotherapy Research, Volume 40, Issue 10, Page 5988-6004, October 2026.
Overview of the antileukemic effects of Piper nigrum extract in AML. P. nigrum reduced leukemic cell proliferation and glycolytic metabolism through modulation of the PI3K/AKT/mTOR pathway. In vivo, treatment reduced leukemic burden, improved hematological parameters, prolonged survival, and modulated antitumor immune responses.
Natalia Murillo, Paola Lasso, Claudia Urueña, Susana Fiorentino   +3 more
wiley   +1 more source

Integration of Machine Learning With PBPK and QSAR Modeling Approaches to Facilitate Drug Discovery and Development. [PDF]

CPT Pharmacometrics Syst Pharmacol
Chen X, Lin Z.
europepmc   +1 more source

Coumarin‐Benzimidazole Hybrids as Multitarget Scaffolds for Antileishmanial Drug Discovery

ChemistrySelect, Volume 11, Issue 38, 13 October 2026.
Coumarin‐benzimidazole hybrids emerge as promising antileishmanial agents through virtual screening against essential Leishmania enzymes, Cathepsin B (CatB), and N‐myristoyltransferase (NMT). Molecular docking and dynamics simulations reveal highly stable target interactions that surpass the reference drug miltefosine (MTF).
Fernanda Melo Jucá, Damião Sampaio de Sousa, Caio Henrique Alexandre Roberto, Márcia Machado Marinho, Emmanuel Silva Marinho   +4 more
wiley   +1 more source

Identification of Small-Molecule Inhibitors of <i>Babesia bovis</i> by High-Throughput SYBR Green I Screening. [PDF]

Pharmaceuticals (Basel)
Miruka SA, Ariefta N, Guswanto A, Fathi A, Lee JS, Komatsu K, Suganuma K, Yokoyama N, Nishikawa Y, Asada M.   +9 more
europepmc   +1 more source

Metronidazole and Eugenol Hybrids as an Alternative Against Multidrug‐Resistant Bacteria

ChemistrySelect, Volume 11, Issue 39, 20 October 2026.
Structures of the synthesized hybrid compounds AC1–AC8. Figure adapted from Pelozo et al. ABSTRACT Antibiotic resistance is a global threat to human and animal health, since several bacterial species have developed different forms of resistance. Therefore, it is essential to seek effective methods to combat bacterial resistance. Research indicates that
João Arthur de Oliveira Borges, Lucas dos Santos Sa, Francisco Ruan Moreira da Silva Santos, Cicera Laura Roque Paulo, Raimundo Luiz Silva Pereira, Daniel Sampaio Alves, Ana Carolina Justino de Araújo, Francisco Nascimento Pereira Junior, Ana Laura Marques Trinca, Douglas Henriques Novais Junior, Lucas Lopardi Franco, Janaína Esmeraldo Rocha, Henrique Douglas Melo Coutinho, Maria Karollyna do Nascimento Silva Leandro   +13 more
wiley   +1 more source

From Executor to Orchestrator: The Pharmacology Scientist in the Age of Agentic AI. [PDF]

Clin Pharmacol Ther
McCoy M, McCoy M.
europepmc   +1 more source

Diving Deeper Into Mechanisms of Acrylamide‐Induced Toxicity: RNA Sequencing Reveals Transcriptomic Alteration and Retrotransposon Expression in Drosophila melanogaster

Environmental Toxicology, Volume 41, Issue 10, Page 1105-1118, October 2026.
ABSTRACT Given the inevitability of human and animal exposure to acrylamide, there is increasing concern regarding its potential health risks. While a number of molecular mechanisms have been proposed, the complexity of acrylamide toxicological pathways and interactions remains incompletely characterized.
Oluwabukola Mary Farodoye, Titilayomi Ayomide Otenaike, Daniela Moreira Mombach, Monica Medeiros Silva, Amos Olalekan Abolaji, Elgion Lucio Da Silva Loreto   +5 more
wiley   +1 more source