These tools will no longer be maintained as of December 31, 2024. Archived website can be found here. PubMed4Hh GitHub repository can be found here. Contact NLM Customer Service if you have questions.


Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

140 related articles for article (PubMed ID: 36678617)

  • 1. Integrative Ligand-Based Pharmacophore Modeling, Virtual Screening, and Molecular Docking Simulation Approaches Identified Potential Lead Compounds against Pancreatic Cancer by Targeting FAK1.
    Molla MHR; Aljahdali MO; Sumon MAA; Asseri AH; Altayb HN; Islam MS; Alsaiari AA; Opo FADM; Jahan N; Ahammad F; Mohammad F
    Pharmaceuticals (Basel); 2023 Jan; 16(1):. PubMed ID: 36678617
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Identification of novel natural drug candidates against BRAF mutated carcinoma; An integrative in-silico structure-based pharmacophore modeling and virtual screening process.
    Dain Md Opo FA; Alsaiari AA; Rahman Molla MH; Ahmed Sumon MA; Yaghmour KA; Ahammad F; Mohammad F; Simal-Gandara J
    Front Chem; 2022; 10():986376. PubMed ID: 36267655
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Pharmacophore-Based Virtual Screening, Quantum Mechanics Calculations, and Molecular Dynamics Simulation Approaches Identified Potential Natural Antiviral Drug Candidates against MERS-CoV S1-NTD.
    Bouback TA; Pokhrel S; Albeshri A; Aljohani AM; Samad A; Alam R; Hossen MS; Al-Ghamdi K; Talukder MEK; Ahammad F; Qadri I; Simal-Gandara J
    Molecules; 2021 Aug; 26(16):. PubMed ID: 34443556
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Pharmacophore modeling, multiple docking, and molecular dynamics studies on Wee1 kinase inhibitors.
    Hu Y; Zhou L; Zhu X; Dai D; Bao Y; Qiu Y
    J Biomol Struct Dyn; 2019 Jul; 37(10):2703-2715. PubMed ID: 30052133
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Toward the Identification of Natural Antiviral Drug Candidates against Merkel Cell Polyomavirus: Computational Drug Design Approaches.
    Asseri AH; Alam MJ; Alzahrani F; Khames A; Pathan MT; Abourehab MAS; Hosawi S; Ahmed R; Sultana SA; Alam NF; Alam NU; Alam R; Samad A; Pokhrel S; Kim JK; Ahammad F; Kim B; Tan SC
    Pharmaceuticals (Basel); 2022 Apr; 15(5):. PubMed ID: 35631328
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Pharmacophore-Model-Based Virtual-Screening Approaches Identified Novel Natural Molecular Candidates for Treating Human Neuroblastoma.
    Opo FADM; Alkarim S; Alrefaei GI; Molla MHR; Alsubhi NH; Alzahrani F; Ahammad F
    Curr Issues Mol Biol; 2022 Oct; 44(10):4838-4858. PubMed ID: 36286044
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Structure-Based Pharmacophore Modeling, Virtual Screening, Molecular Docking, ADMET, and Molecular Dynamics (MD) Simulation of Potential Inhibitors of PD-L1 from the Library of Marine Natural Products.
    Luo L; Zhong A; Wang Q; Zheng T
    Mar Drugs; 2021 Dec; 20(1):. PubMed ID: 35049884
    [TBL] [Abstract][Full Text] [Related]  

  • 8. 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]  

  • 9. Epigallocatechin gallate and curcumin inhibit Bcl-2: a pharmacophore and docking based approach against cancer.
    Bahadar N; Bahadar S; Sajid A; Wahid M; Ali G; Alghamdi A; Zada H; Khan T; Ullah S; Sun Q
    Breast Cancer Res; 2024 Jul; 26(1):114. PubMed ID: 38978121
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Identification of potential PKC inhibitors through pharmacophore designing, 3D-QSAR and molecular dynamics simulations targeting Alzheimer's disease.
    Iqbal S; Anantha Krishnan D; Gunasekaran K
    J Biomol Struct Dyn; 2018 Nov; 36(15):4029-4044. PubMed ID: 29182053
    [TBL] [Abstract][Full Text] [Related]  

  • 11. In silico identification of potential inhibitors against shikimate dehydrogenase through virtual screening and toxicity studies for the treatment of tuberculosis.
    Isa MA; Majumdar RS; Haider S
    Int Microbiol; 2019 Mar; 22(1):7-17. PubMed ID: 30810932
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Exploration of New and Potent Lead Molecules Against CAAX Prenyl Protease I of Leishmania donovani Through Pharmacophore Based Virtual Screening Approach.
    Prabhu SV; Tiwari K; Suryanarayanan V; Dubey VK; Singh SK
    Comb Chem High Throughput Screen; 2017; 20(3):255-271. PubMed ID: 28116998
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Identification of Potent and Selective JAK1 Lead Compounds Through Ligand-Based Drug Design Approaches.
    Babu S; Nagarajan SK; Sathish S; Negi VS; Sohn H; Madhavan T
    Front Pharmacol; 2022; 13():837369. PubMed ID: 35529449
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Pharmacoinformatics and molecular dynamics simulation-based phytochemical screening of neem plant (Azadiractha indica) against human cancer by targeting MCM7 protein.
    Ahammad F; Alam R; Mahmud R; Akhter S; Talukder EK; Tonmoy AM; Fahim S; Al-Ghamdi K; Samad A; Qadri I
    Brief Bioinform; 2021 Sep; 22(5):. PubMed ID: 33834183
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Pharmacophore based virtual screening, molecular docking and molecular dynamic simulation studies for finding ROS1 kinase inhibitors as potential drug molecules.
    Vanajothi R; Vedagiri H; Al-Ansari MM; Al-Humaid LA; Kumpati P
    J Biomol Struct Dyn; 2022 May; 40(8):3385-3399. PubMed ID: 33200682
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Integrating Ligand and Target-Driven Based Virtual Screening Approaches With
    Tutumlu G; Dogan B; Avsar T; Orhan MD; Calis S; Durdagi S
    Front Chem; 2020; 8():167. PubMed ID: 32328476
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Compounds Identified from Marine Mangrove Plant
    Aljahdali MO; Molla MHR; Ahammad F
    Mar Drugs; 2021 Apr; 19(5):. PubMed ID: 33925208
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Identification of selective MMP-9 inhibitors through multiple e-pharmacophore, ligand-based pharmacophore, molecular docking, and density functional theory approaches.
    Jana S; Singh SK
    J Biomol Struct Dyn; 2019 Mar; 37(4):944-965. PubMed ID: 29475408
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Identification of novel discoidin domain receptor 1 (DDR1) inhibitors using E-pharmacophore modeling, structure-based virtual screening, molecular dynamics simulation and MM-GBSA approaches.
    Nada H; Lee K; Gotina L; Pae AN; Elkamhawy A
    Comput Biol Med; 2022 Mar; 142():105217. PubMed ID: 35032738
    [TBL] [Abstract][Full Text] [Related]  

  • 20.
    Shirvani P; Fassihi A
    J Biomol Struct Dyn; 2022 Aug; 40(13):5965-5982. PubMed ID: 33475043
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 7.