Sökresultat - "Pharmacoinformatics"

Predicting tuberculosis drug efficacy in preclinical and clinical models from in vitro data.

Goh, Janice, Patel, Anu, Ngara, Bernard, van Wijk, Rob, Strydom, Natasha, Wang, Qianwen, Van, Nhi, Washington, Tracy, Nuermberger, Eric, Aldridge, Bree, Roubert, Christine, Sarathy, Jansy, Dartois, Véronique, Savic, Rada

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Proteomic analysis of synergetic neuroprotective effect of adenosine, thiamine, niacin and cyanocobalamin in pathophysiology of diabetic polyneuropathy

O. A. Gromova, I. Yu. Torshin, A. G. Moiseenok

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Chemoreactome prediction of anti-inflammatory, analgesic, ulcerogenic effects of the candidate molecule N-allylimidazole-zinc in comparison with zinc derivatives of nonsteroidal anti-inflammatory drugs

P. A. Galenko-Yaroshevsky, A. V. Sergeeva, I. Yu. Torshin, A. N. Gromov, I. A. Reyer, O. A. Gromova, B. A. Trofimov, L. N. Parshina, R. A. Murashko, A. V. Zadorozhniy, A. V. Zelenskaya, N. S. Sergeev, Yu. V. Tovkach, O. N. Gulevskaya, I. V. Sholl

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Promoting vascular stability through Src inhibition and Tie2 activation: A model-based analysis

Yu Zhang, Christopher D. Kontos, Brian H. Annex, Aleksander S. Popel

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Cancer pharmacoinformatics: Databases and analytical tools

Kamble, Pradnya, Nagar, Prinsa R., Bhakhar, Kaushikkumar A., Garg, Prabha, Sobhia, M. Elizabeth, Naidu, Srivatsava, Bharatam, Prasad V.^{Aff1, Aff3, IDs10142024014455_cor7}

GAINET: Enhancing drug–drug interaction predictions through graph neural networks and attention mechanisms

Das, Bihter, Dagdogen, Huseyin Alperen, Kaya, Muhammed Onur, Tuncel, Ozkan, Akgul, Muhammed Samet, Das, Resul ^⁎

De novo generation of dual-target compounds using artificial intelligence

Kasumi Yasuda, Francois Berenger, Kazuma Amaike, Ayaka Ueda, Tomoya Nakagomi, Genki Hamasaki, Chen Li, Noriko Yuyama Otani, Kazuma Kaitoh, Koji Tsuda, Kenichiro Itami, Yoshihiro Yamanishi

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Lignan 7-hydroxymatairesinol in the context of post-genomic pharmacology

А. N. Rubashkina, I. Yu. Torshin, O. A. Gromova, A. N. Galustyan

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Chemoreactomic study of fonturacetam effects: molecular mechanisms of influence on adipose tissue metabolism

O. A. Gromova, I. Yu. Torshin

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A multi-task domain-adapted model to predict chemotherapy response from mutations in recurrently altered cancer genes

Jayagopal, Aishwarya ^{1, 7}, Walsh, Robert J. ^{2, 7}, Hariprasannan, Krishna Kumar ¹, Mariappan, Ragunathan ¹, Mahapatra, Debabrata ⁶, Jaynes, Patrick William ³, Lim, Diana ⁴, Peng Tan, David Shao ^{2, 3, 5}, Tan, Tuan Zea ³, Pitt, Jason J. ³, Jeyasekharan, Anand D. ^{2, 3, ∗}, Rajan, Vaibhav ^{1, 8, ∗∗}

Pharmacoinformational, basic and clinical studies of 7-hydroxymatairesinol in the context of searching for effective and safe therapeutic approaches to the treatment of mastopathy

А. N. Rubashkina, I. Yu. Torshin, O. A. Gromova

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Chemoreactomic analysis of acyzole in comparison with zinc derivatives of nonsteroidal anti-inflammatory drugs

P. A. Galenko-Yaroshevsky, I. Yu. Torshin, A. N. Gromov, O. A. Gromova, R. A. Murashko, A. V. Zelenskaya, L. O. Alukhanyan, O. V. Shelemekh

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Chemoreactome screening of aquacobalamin and heptamethyl ester of cyanoaquacobyrinic acid cytotoxic effects on tumor cells with experimental confirmation on BT-474 and A549 cell

I. Yu. Torshin, M. V. Filimonova, O. A. Gromova, L. A. Maiorova, M. A. Sorokina, D. E. Frolova, A. N. Gromov, I. A. Reyer

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Comparative chemomicrobiomic analysis of bacteriocins

I. Yu. Torshin, O. A. Gromova

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Editorial: Pharmacoinformatics: new developments and challenges in drug design

David Ramírez, Rafael Peláez, Carlos F. Lagos, José L. Medina-Franco

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Predicting therapeutic and side effects from drug binding affinities to human proteome structures

Sawada, Ryusuke ^{1, 2, 4}, Sakajiri, Yuko ^{1, 3, 4}, Shibata, Tomokazu ¹, Yamanishi, Yoshihiro ^{1, 3, 5, ∗}

Possibilities of using coenzyme Q10 for the treatment of diseases associated with mitochondrial dysfunction and chronic inflammation

O. A. Gromova, I. Yu. Torshin, A. N. Gromov

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Molecular pharmacology of coenzyme Q10 in the context of treatment of hyperlipidemic conditions

O. A. Gromova, I. Yu. Torshin

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In silico analysis and theratyping of an ultra-rare CFTR genotype (W57G/A234D) in primary human rectal and nasal epithelial cells

Kleinfelder, Karina ^{1, 14}, Lotti, Virginia ^{1, 14, 15}, Eramo, Adriana ^{2, 14}, Amato, Felice ^{3, 4}, Lo Cicero, Stefania ², Castelli, Germana ², Spadaro, Francesca ⁵, Farinazzo, Alessia ^{1, 15}, Dell’Orco, Daniele ⁶, Preato, Sara ¹, Conti, Jessica ¹, Rodella, Luca ⁷, Tomba, Francesco ⁷, Cerofolini, Angelo ⁷, Baldisseri, Elena ⁸, Bertini, Marina ⁸, Volpi, Sonia ⁸, Villella, Valeria Rachela ^{3, 4}, Esposito, Speranza ^{3, 4}, Zollo, Immacolata ^{3, 4}, Castaldo, Giuseppe ^{3, 4}, Laudanna, Carlo ¹, Sorsher, Eric J. ⁹, Hong, Jeong ⁹, Joshi, Disha ⁹, Cutting, Garry ¹⁰, Lucarelli, Marco ^{11, 12}, Melotti, Paola ^{8, 13}, Sorio, Claudio ^{1, 13, 16, ∗}

Mechanism of XiJiaQi in the treatment of chronic heart failure: Integrated analysis by pharmacoinformatics, molecular dynamics simulation, and SPR validation

Zhao, Dongyang ^{a, 1}, Guo, Kaijing ^{a, 1}, Zhang, Qian ^b, Wu, Yan ^a, Ma, Chen ^a, He, Wenyi ^a, Jin, Xiangju ^a, Zhang, Xinyu ^a, Wang, Yanan ^{a, ∗}, Lin, Sheng ^{b, ∗∗∗}, Shang, Hongcai ^{b, ∗∗}