Cargando…

Identification of potent inhibitors of NEK7 protein using a comprehensive computational approach

NIMA related Kinases (NEK7) plays an important role in spindle assembly and mitotic division of the cell. Over expression of NEK7 leads to the progression of different cancers and associated malignancies. It is becoming the next wave of targets for the development of selective and potent anti-cancer...

Descripción completa

Detalles Bibliográficos
Autores principales:	Aziz, Mubashir, Ejaz, Syeda Abida, Tamam, Nissren, Siddique, Farhan, Riaz, Naheed, Qais, Faizan Abul, Chtita, Samir, Iqbal, Jamshed
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Nature Publishing Group UK 2022
Materias:	Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9016071/ https://www.ncbi.nlm.nih.gov/pubmed/35436996 http://dx.doi.org/10.1038/s41598-022-10253-5

Ejemplares similares

Discovery of Phenylcarbamoylazinane-1,2,4-Triazole Amides Derivatives as the Potential Inhibitors of Aldo-Keto Reductases (AKR1B1 & AKRB10): Potential Lead Molecules for Treatment of Colon Cancer
por: Saeed, Amna, et al.
Publicado: (2022)

Revisiting the inhibitory potential of protein kinase inhibitors against NEK7 protein via comprehensive computational investigations
por: Ejaz, Syeda Abida, et al.
Publicado: (2023)

Deep Learning and Structure-Based Virtual Screening for Drug Discovery against NEK7: A Novel Target for the Treatment of Cancer
por: Aziz, Mubashir, et al.
Publicado: (2022)

Synthesis, characterization and biological evaluation of pyrazole-based benzene sulfonamides as inhibitors of human carbonic anhydrase II, IX and XII
por: Hussain, Tajamul, et al.
Publicado: (2023)

Computational Investigation of 1, 3, 4 Oxadiazole Derivatives as Lead Inhibitors of VEGFR 2 in Comparison with EGFR: Density Functional Theory, Molecular Docking and Molecular Dynamics Simulation Studies
por: Bilal, Muhammad Sajjad, et al.
Publicado: (2022)

Pharmacophore-Based Virtual Screening and In-Silico Explorations of Biomolecules (Curcumin Derivatives) of Curcuma longa as Potential Lead Inhibitors of ERBB and VEGFR-2 for the Treatment of Colorectal Cancer
por: Ejaz, Syeda Abida, et al.
Publicado: (2023)

Synthesis, Biological Evaluation, and Molecular Dynamics of Carbothioamides Derivatives as Carbonic Anhydrase II and 15-Lipoxygenase Inhibitors
por: Channar, Pervaiz Ali, et al.
Publicado: (2022)

Anti-quorum sensing and biofilm inhibitory effect of some medicinal plants against gram-negative bacterial pathogens: in vitro and in silico investigations
por: Samreen, et al.
Publicado: (2022)

Kinase Inhibitor Profile for Human Nek1, Nek6, and Nek7 and Analysis of the Structural Basis for Inhibitor Specificity
por: Moraes, Eduardo Cruz, et al.
Publicado: (2015)

Analysis of 1-Aroyl-3-[3-chloro-2-methylphenyl] Thiourea Hybrids as Potent Urease Inhibitors: Synthesis, Biochemical Evaluation and Computational Approach
por: Rasheed, Samina, et al.
Publicado: (2022)

Tricyclic coumarin sulphonate derivatives with alkaline phosphatase inhibitory effects: in vitro and docking studies
por: Iqbal, Jamshed, et al.
Publicado: (2018)

In silico investigation of phytoconstituents from Cameroonian medicinal plants towards COVID-19 treatment
por: Chtita, Samir, et al.
Publicado: (2022)

Mechanistic basis of Nek7 activation through Nek9 binding and induced dimerization
por: Haq, Tamanna, et al.
Publicado: (2015)

Unsymmetrical aromatic disulfides as SARS-CoV-2 Mpro inhibitors: Molecular docking, molecular dynamics, and ADME scoring investigations
por: Chtita, Samir, et al.
Publicado: (2022)

[1, 8]-Naphthyridine derivatives as dual inhibitor of alkaline phosphatase and carbonic anhydrase
por: Alrokayan, Salman, et al.
Publicado: (2023)

Biofabrication of Gold Nanoparticles Using Capsicum annuum Extract and Its Antiquorum Sensing and Antibiofilm Activity against Bacterial Pathogens
por: Qais, Faizan Abul, et al.
Publicado: (2021)

An Autoinhibitory Tyrosine Motif in the Cell-Cycle-Regulated Nek7 Kinase Is Released through Binding of Nek9
por: Richards, Mark W., et al.
Publicado: (2009)

Characterization of the Human NEK7 Interactome Suggests Catalytic and Regulatory Properties Distinct from Those of NEK6
por: de Souza, Edmarcia Elisa, et al.
Publicado: (2014)

Physiological and Pathological Roles of Mammalian NEK7
por: Sun, Zhenzhen, et al.
Publicado: (2020)

Hypothyroidism correlates with dyslipidemia and protein contents in patients with various metabolic disorders
por: Kiran, Muniba, et al.
Publicado: (2022)

Deep learning‐based convolutional neural network for intramodality brain MRI synthesis
por: Osman, Alexander F. I., et al.
Publicado: (2022)

Attention‐aware 3D U‐Net convolutional neural network for knowledge‐based planning 3D dose distribution prediction of head‐and‐neck cancer
por: Osman, Alexander F. I., et al.
Publicado: (2022)

Contrast‐enhanced MRI synthesis using dense‐dilated residual convolutions based 3D network toward elimination of gadolinium in neuro‐oncology
por: Osman, Alexander F. I., et al.
Publicado: (2023)

Comprehensive substrate specificity profiling of the human Nek kinome reveals unexpected signaling outputs
por: van de Kooij, Bert, et al.
Publicado: (2019)

Novel adamantyl clubbed iminothiazolidinones as promising elastase inhibitors: design, synthesis, molecular docking, ADMET and DFT studies
por: Ahmed, Atteeque, et al.
Publicado: (2022)

Synthesis and Evaluation of Novel S-alkyl Phthalimide- and S-benzyl-oxadiazole-quinoline Hybrids as Inhibitors of Monoamine Oxidase and Acetylcholinesterase
por: Khan, Bilal Ahmad, et al.
Publicado: (2022)

NEK7 is required for G1 progression and procentriole formation
por: Gupta, Akshari, et al.
Publicado: (2017)

Design, Synthesis, Kinetic Analysis and Pharmacophore-Directed Discovery of 3-Ethylaniline Hybrid Imino-Thiazolidinone as Potential Inhibitor of Carbonic Anhydrase II: An Emerging Biological Target for Treatment of Cancer
por: Ahmed, Atteeque, et al.
Publicado: (2022)

Synthesis, DFT and molecular docking of novel (Z)-4-bromo-N-(4-butyl-3 (quinolin-3-yl)thiazol-2(3H)-ylidene)benzamide as elastase inhibitor
por: Mustafa, Muhammad Naeem, et al.
Publicado: (2023)

Mitotic Regulation by NEK Kinase Networks
por: Fry, Andrew M., et al.
Publicado: (2017)

Up to your NEK2 in CIN
por: Seachrist, Darcie D., et al.
Publicado: (2021)

In-silico Investigations of quinine and quinidine as potential Inhibitors of AKR1B1 and AKR1B10: Functional and structural characterization
por: Ejaz, Syeda Abida, et al.
Publicado: (2022)

Bioactive extracts of Carum copticum L. enhances efficacy of ciprofloxacin against MDR enteric bacteria
por: Maheshwari, Meenu, et al.
Publicado: (2019)

Identification of a novel Sorcin isoform with a different C-terminal but intact dimerization property
por: Tanwar, Supriya, et al.
Publicado: (2023)

QSAR, molecular docking and ADMET properties in silico studies of novel 4,5,6,7-tetrahydrobenzo[D]-thiazol-2-Yl derivatives derived from dimedone as potent anti-tumor agents through inhibition of C-Met receptor tyrosine kinase
por: Daoui, Ossama, et al.
Publicado: (2021)

Synthesis, kinetic studies and in-silico investigations of novel quinolinyl-iminothiazolines as alkaline phosphatase inhibitors
por: Mustafa, Muhammad Naeem, et al.
Publicado: (2023)

The Microtubule Regulator NEK7 Coordinates the Wiring of Cortical Parvalbumin Interneurons
por: Hinojosa, Antonio Jesús, et al.
Publicado: (2018)

NEK7 Coordinates Rapid Neuroinflammation After Subarachnoid Hemorrhage in Mice
por: Li, Gen, et al.
Publicado: (2020)

Structural mechanism for NEK7-licensed NLRP3 inflammasome activation
por: Sharif, Humayun, et al.
Publicado: (2019)

An Oval-Square Shaped Split Ring Resonator Based Left-Handed Metamaterial for Satellite Communications and Radar Applications
por: Idrus, Ismatul Nisak, et al.
Publicado: (2022)

Cannot write session to /tmp/vufind_sessions/sess_su367ikb2smus89jcphqho1ash