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Akademický článek

Identification of a New Promising BAG3 Modulator Featuring the Imidazopyridine Scaffold

Autor: Dafne Ruggiero, Emis Ingenito, Eleonora Boccia, Vincenzo Vestuto, Maria Rosaria Miranda, Stefania Terracciano, Gianluigi Lauro, Giuseppe Bifulco, Ines Bruno

Publikováno v: Molecules, Vol 29, Iss 21, p 5051 (2024)

The antiapoptotic BAG3 protein plays a crucial role in cellular proteostasis and it is involved in several signalling pathways governing cell proliferation and survival. Owing to its multimodular structure, it possesses an extensive interactome inclu

Externí odkaz: https://doaj.org/article/4a0d6d884ea84ec4b0f2114bf34d86f9

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Akademický článek

Identification of Novel Bromodomain-Containing Protein 4 (BRD4) Binders through 3D Pharmacophore-Based Repositioning Screening Campaign

Autor: Ester Colarusso, Erica Gazzillo, Eleonora Boccia, Stefania Terracciano, Ines Bruno, Giuseppe Bifulco, Maria Giovanna Chini, Gianluigi Lauro

Publikováno v: Molecules, Vol 29, Iss 17, p 4025 (2024)

A 3D structure-based pharmacophore model built for bromodomain-containing protein 4 (BRD4) is reported here, specifically developed for investigating and identifying the key structural features of the (+)-JQ1 known inhibitor within the BRD4 binding s

Externí odkaz: https://doaj.org/article/4c4d5af09cf840049e468ff4e7d95879

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Akademický článek

Repositioning of Quinazolinedione-Based Compounds on Soluble Epoxide Hydrolase (sEH) through 3D Structure-Based Pharmacophore Model-Driven Investigation

Autor: Erica Gazzillo, Stefania Terracciano, Dafne Ruggiero, Marianna Potenza, Maria Giovanna Chini, Gianluigi Lauro, Katrin Fischer, Robert Klaus Hofstetter, Assunta Giordano, Oliver Werz, Ines Bruno, Giuseppe Bifulco

Publikováno v: Molecules, Vol 27, Iss 12, p 3866 (2022)

The development of new bioactive compounds represents one of the main purposes of the drug discovery process. Various tools can be employed to identify new drug candidates against pharmacologically relevant biological targets, and the search for new

Externí odkaz: https://doaj.org/article/968f9ee74c334cf49eabf861eeb7485d

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Akademický článek

Identification of 2-(thiophen-2-yl)acetic Acid-Based Lead Compound for mPGES-1 Inhibition

Autor: Simone Di Micco, Stefania Terracciano, Dafne Ruggiero, Marianna Potenza, Maria C. Vaccaro, Katrin Fischer, Oliver Werz, Ines Bruno, Giuseppe Bifulco

Publikováno v: Frontiers in Chemistry, Vol 9 (2021)

We report the implementation of our in silico/synthesis pipeline by targeting the glutathione-dependent enzyme mPGES-1, a valuable macromolecular target in both cancer therapy and inflammation therapy. Specifically, by using a virtual fragment screen

Externí odkaz: https://doaj.org/article/71095209381047b3a5acfad96c27ae5e

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Akademický článek

Structural Refinement of 2,4-Thiazolidinedione Derivatives as New Anticancer Agents Able to Modulate the BAG3 Protein

Autor: Dafne Ruggiero, Stefania Terracciano, Gianluigi Lauro, Michela Pecoraro, Silvia Franceschelli, Giuseppe Bifulco, Ines Bruno

Publikováno v: Molecules, Vol 27, Iss 3, p 665 (2022)

The multidomain BAG3 protein is a member of the BAG (Bcl-2-associated athanogene) family of co-chaperones, involved in a wide range of protein–protein interactions crucial for many key cellular pathways, including autophagy, cytoskeletal dynamics,

Externí odkaz: https://doaj.org/article/90866a69328243cd812d607ba3ef888c

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