Virtual drug repurposing study against SARS-CoV-2 TMPRSS2 target

por DURDAĞI, Serdar
Publicado 2020

Combined ligand and structure-based virtual screening approaches for identification of novel AChE inhibitors

por ŞAHİN, Kader, DURDAĞI, Serdar
Publicado 2020

Investigation of PDE5/PDE6 and PDE5/PDE11 selective potent tadalafil-like PDE5 inhibitors using combination of molecular modeling approaches, molecular fingerprint-based virtual sc...

por Kayık, Gülru, Tüzün, Nurcan Ş., Durdagi, Serdar
Publicado 2017

Investigation of Inhibition Mechanism of Chemokine Receptor CCR5 by Micro-second Molecular Dynamics Simulations

por Salmas, Ramin Ekhteiari, Yurtsever, Mine, Durdagi, Serdar
Publicado 2015

Structural modeling of the N-terminal signal–receiving domain of IκBα

por Yazdi, Samira, Durdagi, Serdar, Naumann, Michael, Stein, Matthias
Publicado 2015

Bis benzothiophene Schiff bases: synthesis and in silico-guided biological activity studies

por ÜNVER, Yasemin, ÜNLÜER, Dilek, DİREKEL, Şahin, DURDAĞI, Serdar
Publicado 2020

Mechanistic insight into the impact of a bivalent ligand on the structure and dynamics of a GPCR oligomer

por Mansoor, Samman, Kayık, Gülru, Durdagi, Serdar, Sensoy, Ozge
Publicado 2022

Evolutionary association of receptor-wide amino acids with G protein–coupling selectivity in aminergic GPCRs

por Selçuk, Berkay, Erol, Ismail, Durdağı, Serdar, Adebali, Ogün
Publicado 2022

Utilizing Heteroatom Types and Numbers from Extensive Ligand Libraries to Develop Novel hERG Blocker QSAR Models Using Machine Learning-Based Classifiers

por Haddad, Safa, Oktay, Lalehan, Erol, Ismail, Şahin, Kader, Durdagi, Serdar
Publicado 2023

Transcription factor NF-κB as target for SARS-CoV-2 drug discovery efforts using inflammation-based QSAR screening model

por Kanan, Tarek, Kanan, Duaa, Al Shardoub, Ebrahim Jaafar, Durdagi, Serdar
Publicado 2021

Discovery of Klotho peptide antagonists against Wnt3 and Wnt3a target proteins using combination of protein engineering, protein–protein docking, peptide docking and molecular dyna...

por Mirza, Shaher Bano, Ekhteiari Salmas, Ramin, Fatmi, M. Qaiser, Durdagi, Serdar
Publicado 2016

Rehabilitating drug-induced long-QT promoters: In-silico design of hERG-neutral cisapride analogues with retained pharmacological activity

por Durdagi, Serdar, Randall, Trevor, Duff, Henry J, Chamberlin, Adam, Noskov, Sergei Y
Publicado 2014

Recent Developments of Carbonic Anhydrase Inhibitors as Potential Drugs

por Iqbal, Jamshed, Al-Rashida, Mariya, Durdagi, Serdar, Alterio, Vincenzo, Di Fiore, Anna
Publicado 2015

Integrating Ligand and Target-Driven Based Virtual Screening Approaches With in vitro Human Cell Line Models and Time-Resolved Fluorescence Resonance Energy Transfer Assay to Ident...

por Tutumlu, Gurbet, Dogan, Berna, Avsar, Timucin, Orhan, Muge Didem, Calis, Seyma, Durdagi, Serdar
Publicado 2020

Prediction of HIV-1 protease resistance using genotypic, phenotypic, and molecular information with artificial neural networks

por Tunc, Huseyin, Dogan, Berna, Darendeli Kiraz, Büşra Nur, Sari, Murat, Durdagi, Serdar, Kotil, Seyfullah
Publicado 2023

Inhibition of acetylcholinesterase and butyrylcholinesterase with uracil derivatives: kinetic and computational studies

por Cavdar, Huseyin, Senturk, Murat, Guney, Murat, Durdagi, Serdar, Kayik, Gulru, Supuran, Claudiu T., Ekinci, Deniz
Publicado 2019

In Silico Analysis of Bacteriocins from Lactic Acid Bacteria Against SARS-CoV-2

por Erol, Ismail, Kotil, Seyfullah Enes, Fidan, Ozkan, Yetiman, Ahmet E., Durdagi, Serdar, Ortakci, Fatih
Publicado 2021

A novel BH3 mimetic Bcl-2 inhibitor promotes autophagic cell death and reduces in vivo Glioblastoma tumor growth

por Calis, Seyma, Dogan, Berna, Durdagi, Serdar, Celebi, Asuman, Yapicier, Ozlem, Kilic, Turker, Turanli, Eda Tahir, Avsar, Timucin
Publicado 2022

Synthesis, biological activity and multiscale molecular modeling studies for coumaryl-carboxamide derivatives as selective carbonic anhydrase IX inhibitors

por Zengin Kurt, Belma, Sonmez, Fatih, Durdagi, Serdar, Aksoydan, Busecan, Ekhteiari Salmas, Ramin, Angeli, Andrea, Kucukislamoglu, Mustafa, Supuran, Claudiu T.
Publicado 2017

Binary-QSAR guided virtual screening of FDA approved drugs and compounds in clinical investigation against SARS-CoV-2 main protease

por OKTAY, Lalehan, ERDEMOĞLU, Ece, TOLU, İlayda, YUMAK, Yeşim, ÖZCAN, Ayşenur, ACAR, Elif, BÜYÜKKILIÇ, Şehriban, OLKAN, Alpsu, DURDAĞI, Serdar
Publicado 2021