BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

167 related articles for article (PubMed ID: 37895928)

  • 21. Photocaging of Pyridinylimidazole-Based Covalent JNK3 Inhibitors Affords Spatiotemporal Control of the Binding Affinity in Live Cells.
    Hoffelner BS; Andreev S; Plank N; Koch P
    Pharmaceuticals (Basel); 2023 Feb; 16(2):. PubMed ID: 37259409
    [TBL] [Abstract][Full Text] [Related]  

  • 22. Novel Tryptanthrin Derivatives with Selectivity as
    Schepetkin IA; Karpenko OS; Kovrizhina AR; Kirpotina LN; Khlebnikov AI; Chekal SI; Radudik AV; Shybinska MO; Quinn MT
    Molecules; 2023 Jun; 28(12):. PubMed ID: 37375361
    [TBL] [Abstract][Full Text] [Related]  

  • 23. Identification of novel serotonin reuptake inhibitors targeting central and allosteric binding sites: A virtual screening and molecular dynamics simulations study.
    Erol I; Aksoydan B; Kantarcioglu I; Salmas RE; Durdagi S
    J Mol Graph Model; 2017 Jun; 74():193-202. PubMed ID: 28499269
    [TBL] [Abstract][Full Text] [Related]  

  • 24. Identification of novel PI3Kδ inhibitors by docking, ADMET prediction and molecular dynamics simulations.
    Liu YY; Feng XY; Jia WQ; Jing Z; Xu WR; Cheng XC
    Comput Biol Chem; 2019 Feb; 78():190-204. PubMed ID: 30557817
    [TBL] [Abstract][Full Text] [Related]  

  • 25. Discovery of 3-alkyl-5-aryl-1-pyrimidyl-1
    Oh Y; Jang M; Cho H; Yang S; Im D; Moon H; Hah JM
    J Enzyme Inhib Med Chem; 2020 Dec; 35(1):372-376. PubMed ID: 31856610
    [TBL] [Abstract][Full Text] [Related]  

  • 26. Targeting the NF-κB/IκBα complex via fragment-based E-Pharmacophore virtual screening and binary QSAR models.
    Kanan T; Kanan D; Erol I; Yazdi S; Stein M; Durdagi S
    J Mol Graph Model; 2019 Jan; 86():264-277. PubMed ID: 30415122
    [TBL] [Abstract][Full Text] [Related]  

  • 27. Targeting PDE4A for therapeutic potential: exploiting drug repurposing approach through virtual screening and molecular dynamics.
    Shamsi A; Khan MS; Altwaijry N; Hassan N; Shahwan M; Yadav DK
    J Biomol Struct Dyn; 2024 Jan; ():1-13. PubMed ID: 38287492
    [TBL] [Abstract][Full Text] [Related]  

  • 28. Rational modification, synthesis and biological evaluation of 3,4-dihydroquinoxalin-2(1H)-one derivatives as potent and selective c-Jun N-terminal kinase 3 (JNK3) inhibitors.
    Dou X; Huang H; Jiang L; Zhu G; Jin H; Jiao N; Zhang L; Liu Z; Zhang L
    Eur J Med Chem; 2020 Sep; 201():112445. PubMed ID: 32603981
    [TBL] [Abstract][Full Text] [Related]  

  • 29. Pyridopyrimidinone Derivatives as Potent and Selective c-Jun N-Terminal Kinase (JNK) Inhibitors.
    Zheng K; Park CM; Iqbal S; Hernandez P; Park H; LoGrasso PV; Feng Y
    ACS Med Chem Lett; 2015 Apr; 6(4):413-8. PubMed ID: 25893042
    [TBL] [Abstract][Full Text] [Related]  

  • 30. Discovery of novel selective PI3Kγ inhibitors through combining machine learning-based virtual screening with multiple protein structures and bio-evaluation.
    Zhu J; Li K; Xu L; Cai Y; Chen Y; Zhao X; Li H; Huang G; Jin J
    J Adv Res; 2022 Feb; 36():1-13. PubMed ID: 35127160
    [TBL] [Abstract][Full Text] [Related]  

  • 31. Suppression of LPS-Induced Inflammation and Cell Migration by Azelastine through Inhibition of JNK/NF-κB Pathway in BV2 Microglial Cells.
    Nguyen PL; Bui BP; Duong MTH; Lee K; Ahn HC; Cho J
    Int J Mol Sci; 2021 Aug; 22(16):. PubMed ID: 34445767
    [TBL] [Abstract][Full Text] [Related]  

  • 32. High-throughput virtual screening of potential inhibitors of GPR52 using docking and biased sampling method for Huntington's disease therapy.
    Gupta H; Sahi S
    Mol Divers; 2023 Dec; ():. PubMed ID: 38038795
    [TBL] [Abstract][Full Text] [Related]  

  • 33. Virtual screening, pharmacokinetics, molecular dynamics and binding free energy analysis for small natural molecules against cyclin-dependent kinase 5 for Alzheimer's disease.
    Shukla R; Singh TR
    J Biomol Struct Dyn; 2020 Jan; 38(1):248-262. PubMed ID: 30688165
    [TBL] [Abstract][Full Text] [Related]  

  • 34. Metadynamics as a Postprocessing Method for Virtual Screening with Application to the Pseudokinase Domain of JAK2.
    Cutrona KJ; Newton AS; Krimmer SG; Tirado-Rives J; Jorgensen WL
    J Chem Inf Model; 2020 Sep; 60(9):4403-4415. PubMed ID: 32383599
    [TBL] [Abstract][Full Text] [Related]  

  • 35. Virtual screening of small molecules databases for discovery of novel PARP-1 inhibitors: combination of in silico and in vitro studies.
    Ekhteiari Salmas R; Unlu A; Bektaş M; Yurtsever M; Mestanoglu M; Durdagi S
    J Biomol Struct Dyn; 2017 Jul; 35(9):1899-1915. PubMed ID: 27315035
    [TBL] [Abstract][Full Text] [Related]  

  • 36. Novel and Potential Small Molecule Scaffolds as DYRK1A Inhibitors by Integrated Molecular Docking-Based Virtual Screening and Dynamics Simulation Study.
    Shahroz MM; Sharma HK; Altamimi ASA; Alamri MA; Ali A; Ali A; Alqahtani S; Altharawi A; Alabbas AB; Alossaimi MA; Riadi Y; Firoz A; Afzal O
    Molecules; 2022 Feb; 27(4):. PubMed ID: 35208955
    [TBL] [Abstract][Full Text] [Related]  

  • 37. Computer-aided identification of lead compounds as Staphylococcal epidermidis FtsZ inhibitors using molecular docking, virtual screening, DFT analysis, and molecular dynamic simulation.
    Tripathy S; Sahu SK; Azam MA; Jupudi S
    J Mol Model; 2019 Nov; 25(12):360. PubMed ID: 31773394
    [TBL] [Abstract][Full Text] [Related]  

  • 38. Identification of Novel Covalent XPO1 Inhibitors Based on a Hybrid Virtual Screening Strategy.
    Shen Z; Zhuang W; Li K; Guo Y; Qu B; Chen S; Gao J; Liu J; Xu L; Dong X; Che J; Li Q
    Molecules; 2022 Apr; 27(8):. PubMed ID: 35458742
    [TBL] [Abstract][Full Text] [Related]  

  • 39. Virtual Screening and Biological Activity Evaluation of New Potent Inhibitors Targeting LRRK2 Kinase Domain.
    Tan S; Gong X; Liu H; Yao X
    ACS Chem Neurosci; 2021 Sep; 12(17):3214-3224. PubMed ID: 34387082
    [TBL] [Abstract][Full Text] [Related]  

  • 40. DENVIS: Scalable and High-Throughput Virtual Screening Using Graph Neural Networks with Atomic and Surface Protein Pocket Features.
    Krasoulis A; Antonopoulos N; Pitsikalis V; Theodorakis S
    J Chem Inf Model; 2022 Oct; 62(19):4642-4659. PubMed ID: 36154119
    [TBL] [Abstract][Full Text] [Related]  

    [Previous]   [Next]    [New Search]
    of 9.