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Biorxiv : the Preprint Server for Biology|August 6, 2025
Virtual Screening-Guided Discovery of Small Molecule CHI3L1 Inhibitors with Functional Activity in Glioblastoma SpheroidsBaljit Kaur, Katrin Denzinger, Longfei Zhang, et al.ACS Medicinal Chemistry Letters|November 19, 2025
Virtual Screening-Guided Discovery of Small-Molecule CHI3L1 Inhibitors with Functional Activity in Glioblastoma SpheroidsBaljit Kaur, Katrin Denzinger, Longfei Zhang, et al.International Journal of Molecular Sciences|January 21, 2023
Gut Microbial-Derived Metabolites as Immune Modulators of T Helper 17 and Regulatory T CellsLaura Calvo-Barreiro, Longfei Zhang, Somaya A Abdel-Rahman, et al.Bioorganic & Medicinal Chemistry Letters|January 7, 2024
Design of cyclic peptides as novel inhibitors of ICOS/ICOSL interactionSomaya A Abdel-Rahman, Brianda L Santini, Laura Calvo-Barreiro, et al.ACS Medicinal Chemistry Letters|February 18, 2026
AI-Assisted Discovery and Optimization of Small-Molecule TREM2 Agonists with Functional Microglial ActivitySungwoo Cho, Tibor Viktor Szalai, Farida El Gaamouch, et al.Biorxiv : the Preprint Server for Biology|September 26, 2025
AI-Assisted Discovery and Optimization of Small Molecule TREM2 Agonists with Functional Microglial ActivitySungwoo Cho, Tibor Viktor Szalai, Farida El Gaamouch, et al.Chemical Biology & Drug Design|May 3, 2025
Computational Design of a Bicyclic Peptide Inhibitor Targeting the ICOS/ICOS-L Protein-Protein InteractionLaura Calvo-Barreiro, Maxim Secor, Jovan Damjanovic, et al.Biorxiv : the Preprint Server for Biology|December 12, 2025
HTS-Oracle: Experimentally validated AI-enabled prioritization for generalizable small molecule hit discoveryHossam Nada, Laura Calvo-Barreiro, Natalie Fuchs, et al.ACS Chemical Neuroscience|November 2, 2021
Discovery of Hydroxybenzothiazole Urea Compounds as Multitargeted Agents Suppressing Major Cytotoxic Mechanisms in Neurodegenerative DiseasesYoussef Aboushady, Moustafa Gabr, Ahmed K ElHady, et al.European Journal of Medicinal Chemistry|October 28, 2021
Discovery of novel 6-hydroxybenzothiazole urea derivatives as dual Dyrk1A/α-synuclein aggregation inhibitors with neuroprotective effectsYasmeen T AlNajjar, Moustafa Gabr, Ahmed K ElHady, et al.Pageof 5