Publications by authors named "Alexey A Lagunin"

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Early Transcriptomic Signatures of Immune Response Modulation Following Antiretroviral Therapy in HIV-Infected Patients.
Ekaterina A Stolbova, Anastasia V Pokrovskaya, Andrey B Shemshura, Dmitry E Kireev, Alexey A Lagunin

Int J Mol Sci· November 2025

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Analysis of Genomic and Transcriptomic Data Revealed Key Genes and Processes in the Development of Major Depressive Disorder.
Sergey M Ivanov, Vladislav S Sukhachev, Olga A Tarasova, Alexey A Lagunin, Vladimir V Poroikov

Int J Mol Sci· September 2025

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Sequence-structure based prediction of pathogenicity for amino acid substitutions in proteins associated with primary immunodeficiencies.
Ekaterina S Porfireva, Anton D Zadorozhny, Anastasia V Rudik, Dmitry A Filimonov, Alexey A Lagunin

Front Immunol· May 2025

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DIGEP-Pred 2.0: A web application for predicting drug-induced cell signaling and gene expression changes.
Sergey M Ivanov, Anastasia V Rudik, Alexey A Lagunin, Dmitry A Filimonov, Vladimir V Poroikov

Mol Inform· December 2024

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Analysis of transcription profiles for the identification of master regulators as the key players in glioblastoma.
Sergey M Ivanov, Alexey A Lagunin, Olga A Tarasova

Comput Struct Biotechnol J· December 2024

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Prediction of Protein Secondary Structures Based on Substructural Descriptors of Molecular Fragments.
Oleg S Zakharov, Anastasia V Rudik, Dmitry A Filimonov, Alexey A Lagunin

Int J Mol Sci· November 2024

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MetaTox 2.0: Estimating the Biological Activity Spectra of Drug-like Compounds Taking into Account Probable Biotransformations.
Anastasia V Rudik, Alexander V Dmitriev, Alexey A Lagunin, Dmitry A Filimonov, Vladimir V Poroikov

ACS Omega· December 2023

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Predicting the Impact of OTOF Gene Missense Variants on Auditory Neuropathy Spectrum Disorder.
Dmitry A Dmitriev, Boris V Shilov, Michail M Polunin, Anton D Zadorozhny, Alexey A Lagunin

Int J Mol Sci· December 2023

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Web Service for HIV Drug Resistance Prediction Based on Analysis of Amino Acid Substitutions in Main Drug Targets.
Anastasiia Iu Paremskaia, Anastassia V Rudik, Dmitry A Filimonov, Alexey A Lagunin, Vladimir V Poroikov

Viruses· November 2023

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TCR-Pred: A new web-application for prediction of epitope and MHC specificity for CDR3 TCR sequences using molecular fragment descriptors.
Anton S Smirnov, Anastasia V Rudik, Dmitry A Filimonov, Alexey A Lagunin

Immunology· August 2023

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Prediction of Amino Acid Substitutions in ABL1 Protein Leading to Tumor Drug Resistance Based on "Structure-Property" Relationship Classification Models.
Svetlana I Zhuravleva, Anton D Zadorozhny, Boris V Shilov, Alexey A Lagunin

Life (Basel)· August 2023

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Different iPSC-derived neural stem cells shows various spectrums of spontaneous differentiation during long term cultivation.
Adelya Albertovna Galiakberova, Olga Igorevna Brovkina, Nikolay Vitalyevich Kondratyev, Alexander Sergeevich Artyuhov, Ekaterina Dmitrievna Momotyuk, Alexey Aleksandrovich Lagunin

Front Mol Neurosci· May 2023

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Towards Novel Potential Molecular Targets for Antidepressant and Antipsychotic Pharmacotherapies.
Yuriy M Kositsyn, Murilo S de Abreu, Tatiana O Kolesnikova, Alexey A Lagunin, Vladimir V Poroikov

Int J Mol Sci· May 2023

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CLC-Pred 2.0: A Freely Available Web Application for In Silico Prediction of Human Cell Line Cytotoxicity and Molecular Mechanisms of Action for Druglike Compounds.
Alexey A Lagunin, Anastasia V Rudik, Pavel V Pogodin, Polina I Savosina, Olga A Tarasova

Int J Mol Sci· January 2023

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SAV-Pred: A Freely Available Web Application for the Prediction of Pathogenic Amino Acid Substitutions for Monogenic Hereditary Diseases Studied in Newborn Screening.
Anton D Zadorozhny, Anastasia V Rudik, Dmitry A Filimonov, Alexey A Lagunin

Int J Mol Sci· January 2023

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Pyridine Carboxamides Based on Sulfobetaines: Design, Reactivity, and Biological Activity.
Eugene P Kramarova, Sophia S Borisevich, Edward M Khamitov, Alexander A Korlyukov, Pavel V Dorovatovskii, Alexey A Lagunin

Molecules· November 2022

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The method predicting interaction between protein targets and small-molecular ligands with the wide applicability domain.
Dmitry A Karasev, Boris N Sobolev, Alexey A Lagunin, Dmitry A Filimonov, Vladimir V Poroikov

Comput Biol Chem· June 2022

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Relationships between the Structure and Severe Drug-Induced Liver Injury for Low, Medium, and High Doses of Drugs.
Sergey M Ivanov, Alexey A Lagunin, Dmitry A Filimonov, Vladimir V Poroikov

Chem Res Toxicol· March 2022

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A Novel Phenylpyrrolidine Derivative: Synthesis and Effect on Cognitive Functions in Rats with Experimental Ishemic Stroke.
Denis A Borozdenko, Aiarpi A Ezdoglian, Tatiana A Shmigol, Darya I Gonchar, Dmitri N Lyakhmun, Alexey A Lagunin

Molecules· October 2021

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In Silico Prediction of Drug-Drug Interactions Mediated by Cytochrome P450 Isoforms.
Alexander V Dmitriev, Anastassia V Rudik, Dmitry A Karasev, Pavel V Pogodin, Alexey A Lagunin

Pharmaceutics· April 2021

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Combined network pharmacology and virtual reverse pharmacology approaches for identification of potential targets to treat vascular dementia.
Alexey A Lagunin, Sergey M Ivanov, Tatyana A Gloriozova, Pavel V Pogodin, Dmitry A Filimonov

Sci Rep· January 2020

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AntiBac-Pred: A Web Application for Predicting Antibacterial Activity of Chemical Compounds.
Pavel V Pogodin, Alexey A Lagunin, Anastasia V Rudik, Dmitry S Druzhilovskiy, Dmitry A Filimonov

J Chem Inf Model· November 2019

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Prediction of Drug-Drug Interactions Related to Inhibition or Induction of Drug-Metabolizing Enzymes.
Alexander V Dmitriev, Alexey A Lagunin, Dmitry А Karasev, Anastasia V Rudik, Pavel V Pogodin

Curr Top Med Chem· June 2019

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Rational Use of Heterogeneous Data in Quantitative Structure-Activity Relationship (QSAR) Modeling of Cyclooxygenase/Lipoxygenase Inhibitors.
Alexey A Lagunin, Athina Geronikaki, Phaedra Eleftheriou, Pavel V Pogodin, Alexey V Zakharov

J Chem Inf Model· February 2019

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Comparison of Quantitative and Qualitative (Q)SAR Models Created for the Prediction of K and IC Values of Antitarget Inhibitors.
Alexey A Lagunin, Maria A Romanova, Anton D Zadorozhny, Natalia S Kurilenko, Boris V Shilov

Front Pharmacol· October 2018

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