Publications

 2026

Synthesis, crystal structure, Hirshfeld surface and interaction energies analysis of 3-(benzo[d][1,3]dioxol-5-yl)-2-(pyridin-3-yl) thiazolidin-4-one.
Authors: Summara Kousar, Raed Al‑Qawasmeh, Monther Khanfar, Muhammad Saeed
Journal: European Journal of Chemistry 17(2), 99–108
Publication Date: June 30, 2026
DOI: https://doi.org/10.5155/eurjchem.17.2.99-108.2778

Selective Plastic Photo Upcycling to Acetic Acid via Coupled Oxidation and CO₂ Reduction Over an S‑Scheme g‑C₃N₄/Fe₂O₃ Heterojunction
Authors: Zunaira Muhammad, Muhammad Saeed, Senem Çitoğlu, Hatice Duran, Salman Noshear Arshad
Journal: ChemPlusChem 91(4), e202500710
First Published: April 16, 2026
DOI: https://doi.org/10.1002/cplu.202500710

  2025

Thermoselective Synthesis of Drug Intermediates Using Sulphonic Acid Functionalized Heterogeneous Catalysts
Authors: Shahzad Rasheed, Summara Kousar, Muhammad Saeed, Qandeel Almas
Conference: 2025 AIChE Annual Meeting
Publisher: AIChE
Publication Date: November 4, 2025

Probing Solid‑Supported Alkali and Alkaline Earth Metal Salts‑Based Catalysts in the Multicomponent Synthesis of Acridine‑1,8‑diones: Box–Behnken and Density Functional Theory (DFT) Study
Authors: Nisar Ali, Sehrish Sarfaraz, Hina Asif, Minahil Abbas, Mariya Al‑Rashida, Muhammad Saeed, Sobia Rana, Khurshid Ayub, Abdul Hameed
Journal: ChemistrySelect 10(37), e04095
DOI: https://doi.org/10.1002/slct.202504095

Synthesis, mechanistic insights, and anticancer evaluation of novel 2‑aroylbenzo[b]thiophen‑3‑ols: A DFT and Hirshfeld surface analysis
Authors: Asma Mukhtar, Ali Iftikhar, Maria Maqbool, Amir Faisal, Khurshid Ayub, Sammer Yousuf, Muhammad Saeed
Journal: Journal of Molecular Structure 1324, 140802
DOI: https://doi.org/10.1016/j.molstruc.2024.140802

 2024


Fabrication of CuWO₄@MIL‑101 (Fe) nanocomposite for efficient OER and photodegradation of methylene blue
Authors: Mariam Khan, M.M. Ahmed, M.N. Akhtar, M. Sajid, N.N. Riaz, M. Asif, M. Kashif, … Muhammad Saeed
Journal: Heliyon 10(23)
Publication Year: 2024
DOI:https://doi.org/10.1016/j.heliyon.2024.e40546

Optimization study and application of Box–Behnken model for probing eggshell supported transition metals based catalysts to synthesize hydrazone & dihydropyrimidinones
Authors: Rabia Perveen, F. Latif, M. Abbas, K. Ayub, S. Sarfaraz, Muhammad Saeed, S. Rana, …
Journal: Scientific Reports 14(1), 23270
DOI: https://doi.org/10.1038/s41598-024-74876-6

Synthesis of 3‑methyl‑N‑((4′-(3‑methylbenzamido)‑[1,1′‑biphenyl]‑4‑yl) carbamothioyl) benzamide: X‑ray structural analysis, DFT‑guided investigation, Hirshfeld analysis
Authors: Faiza Younas, A. Saeed, T. Hökelek, C. Schulzke, S. Tahira, B.J. Elvers, Muhammad Saeed
Journal: Journal of Molecular Structure 1311, 138399
DOI:https://doi.org/10.1016/j.molstruc.2024.138399

Iron‑catalysed C–H ortho‑arylation of edaravone, a promising monoamine oxidase‑B inhibitor
Authors: Soneela Asghar, Mattia Manzotti, Alexander Atkins, S. Tailor, H.A. Sparkes, Muhammad Saeed, …
Journal: Tetrahedron 158, 133983
DOI:https://doi.org/10.1016/j.tet.2024.133983

Facile synthesis of substituted 2‑aroylbenzo[b]thiophen‑3‑ols to form novel triazole hybrids using click chemistry
Authors: Asma Mukhtar, Arif Hussain, Faiza Younas, Sammer Yousuf, Muhammad Saeed
Journal: RSC Advances 14(15), 10270–10279
DOI: https://doi.org/10.1039/d4ra01146e


2023

Part‑II: An update of Schiff bases synthesis and applications in medicinal chemistry – a patent review (2016–2023)
Authors: Hafiza Amna Younus, Farwa Saleem, A. Hameed, Mariya Al‑Rashida, Raed Al‑Qawasmeh, … Muhammad Saeed
Journal: Expert Opinion on Therapeutic Patents 33(12), 841–864


Repurposing of investigational cancer drugs: Early phase discovery of dengue virus NS2B/NS3 protease inhibitors
Authors: Hafiza Nosheen Saleem, Summara Kousar, A.H. Jiskani, I. Sohail, Amir Faisal, Muhammad Saeed
Journal: Archiv der Pharmazie e2300292
DOI:https://doi.org/10.1002/ardp.20230029
2

The photocatalytic and antibacterial potential of highly efficient S‑scheme binary S‑gC₃N₄@Co‑zinc ferrite nanocomposite
Authors: Syeda Saba Hassan, M. Javed, M.N. Akhtar, M.A. Qamar, N. Ahmed, Muhammad Saeed, …
Journal: Optical Materials 142, 114046
DOI:https://doi.org/10.1016/j.optmat.2023.114046

Plasma‑based ozonolysis of lignin waste materials for the production of value‑added chemicals
Authors: Rabia Muazzam, A. Hafeez, M. Uroos, Muhammad Saeed, F. Rehman, N. Muhammad
Journal: Biomass Conversion and Biorefinery 13, 5903–5919
DOI: https://doi.org/10.1007/s13399-021-01707-3

Exploring chromone sulfonamides and sulfonylhydrazones as highly selective ectonucleotidase inhibitors: synthesis, biological evaluation and in silico study
Authors: Hafiza Amna Younus, Muhammad Saeed, A. Mahmood, M.S.K. Jadoon, A. Hameed, A. Asari, …
Journal: Bioorganic Chemistry 134, 106450
DOI:https://doi.org/10.1016/j.bioorg.2023.106450


2022

Endophytic bacteria of Fagonia indica Burm. f revealed to harbour rich secondary antibacterial metabolites
Authors: Lubna Rahman, Asma Mukhtar, S. Ahmad, L. Rahman, M. Ali, Muhammad Saeed, Z.K. Shinwari
Journal: PLOS ONE 17(12), e0277825
DOI:https://doi.org/10.1371/journal.pone.0277825

Synthesis, X‑Ray crystallography and HF/DFT analysis of N‑(diethylcarbamothioyl) furan‑2‑carboxamide, analyzed by experimental and theoretical methods
Authors: A. Saeed, S. Ashraf, G. Shabir, T. Hökelek, U. Flörke, Asma Mukhtar, Muhammad Saeed
Journal: Journal of Molecular Structure 1268, 133721
DOI:https://doi.org/10.1016/j.molstruc.2022.133721

Novel carboxylic acid‑capped silver nanoparticles as antimicrobial and colorimetric sensing agents
Authors: Muhammad Imran Irfan, F. Amjad, A. Abbas, M.F.U. Rehman, F. Kanwal, Muhammad Saeed, S. Ullah, …
Journal: Molecules 27(11), 3363
DOI:https://doi.org/10.3390/molecules27113363

Synthetic flavonoids as potential antiviral agents against SARS‑CoV‑2 main protease
Authors: Farwa Batool, Ehsan Ullah Mughal, K. Zia, A. Sadiq, N. Naeem, A. Javid, Z. Ul‑Haq, … Muhammad Saeed
Journal: Journal of Biomolecular Structure and Dynamics 40(8), 3777–3788
DOI:https://doi.org/10.1080/07391102.2022.2045678

Postharvest shelf life enhancement of peach fruit treated with glucose oxidase immobilized on ZnO nanoparticles
Authors: Razia Batool, S.A.R. Kazmi, S. Khurshid, Muhammad Saeed, S. Ali, A. Adnan, F. Altaf, …
Journal: Food Chemistry 366, 130591
DOI:https://doi.org/10.1016/j.foodchem.2021.130591

2021

Minocycline Derived Silver Nanoparticles for Assessment of Their Antidiabetic Potential against Alloxan induced Diabetic Mice
Authors: Syed Akif Raza Kazmi, M.Z. Qureshi, S.S. Alhewairini, S. Ali, S. Khurshid, Muhammad Saeed, …
Journal: Pharmaceutics 13(10), 1678
DOI:https://doi.org/10.3390/pharmaceutics13101678

Catalytic C–O bond cleavage in a β‑O‑4 lignin model through intermolecular hydrogen transfer
Authors: Muhammad Ahsan Usman, M. Naeem, Muhammad Saeed, M. Zaheer
Journal: Inorganica Chimica Acta 521, 120305
DOI:https://doi.org/10.1016/j.ica.2021.120305

Facile Synthesis and In Vitro Activity of N‑Substituted 1,2‑Benzisothiazol‑3(2H)‑ones against Dengue Virus NS2BNS3 Protease
Authors: Farwa Batool, Muhammad Saeed, Hafiza Nosheen Saleem, L. Kirschner, J. Bodem
Journal: Pathogens 10(4), 464
DOI:https://doi.org/10.3390/pathogens10040464

Schiff‑based metal complexes of lamotrigine: design, synthesis, characterization, and biological evaluation
Authors: Saima Najm, Humaira Naureen, K. Sultana, F. Anwar, M.M. Khan, H. Nadeem, Muhammad Saeed
Journal: ACS Omega 6(11), 7719
DOI:https://doi.org/10.1021/acsomega.1c00027
         
2020


Sulfonylhydrazones: Design, synthesis and investigation of ectonucleotidase (ALP & e5′ NT) inhibition activities
Authors: Hafiza Amna Younus, A. Hameed, A. Mahmood, M.S. Khan, Muhammad Saeed, Farwa Batool, …
Journal: Bioorganic Chemistry 100, 103827
DOI:https://doi.org/10.1016/j.bioorg.2020.103827

Synthesis and evaluation of novel S‑benzyl‑ and S‑alkylphthalimide‑oxadiazole‑benzenesulfonamide hybrids as inhibitors of dengue virus protease
Authors: Syeda Shamila Hamdani, B.A. Khan, S. Hameed, Farwa Batool, Hafiza Nosheen Saleem, E.U. Mughal, … Muhammad Saeed
Journal: Bioorganic Chemistry 96, 103567
DOI:https://doi.org/10.1016/j.bioorg.2020.103567

Treatment of HCV Genotype‑1a Infection with Sofosbuvir/Daclatasvir in a Child Suffering from Thalassemia‑Major
Authors: Hafiz Javed Mansoor, M.S. Walayt, H. Ahmed, M.A. Khan, Muhammad Saeed
Journal: RADS Journal of Pharmacy and Pharmaceutical Sciences 8(3), 168–172

 2019

Inhibition of Dengue Virus Protease by Eugeniin, Isobiflorin, and Biflorin Isolated from the Flower Buds of Syzygium aromaticum (Cloves)
Authors: Hafiza Nosheen Saleem, Farwa Batool, Hafiz Javed Mansoor, S. Shahzad‑ul‑Hussan, Muhammad Saeed
Journal: ACS Omega 4(1), 1525–1533
DOI:https://doi.org/10.1021/acsomega.8b02861

Kerr Nonlinearity in germanium selenide nanoflakes measured by Z‑scan and spatial self‑phase modulation techniques
Authors: Yue Jia, Muhammad Saeed, …
Journal: Optics Express 27, 20857
DOI: https://doi.org/10.1364/OE.27.020857

2018


Potential targets for therapeutic intervention and structure‑based vaccine design against Zika virus
Authors: Amina Qadir, M. Riaz, Muhammad Saeed, S. Shahzad‑ul‑Hussan
Journal: European Journal of Medicinal Chemistry 156, 444–460
DOI:https://doi.org/10.1016/j.ejmech.2018.07.014
                        
 2017

Deciphering the Resistance Profile of Cancerous Thymidylate Synthase
Authors: Z. Islam, I. Gurevic, Muhammad Saeed, S. Rasool, Amnon Kohen
Journal: FASEB Journal 31, 921.12


Synthesis of lignin model compound containing a β‑O‑4 linkage
Authors: Asma Mukhtar, M. Zaheer, Muhammad Saeed, W. Voelter
Journal: Zeitschrift für Naturforschung B 72(2), 119–124
DOI: https://doi.org/10.1515/znb-2016-0201  

 2015


Targeting the de novo Biosynthesis of Thymidylate for PET Probe Development in Pancreatic Cancer Imaging
Authors: Thushani D. Nilaweera, Muhammad Saeed, Amnon Kohen
Journal: Biochemistry 54(5), 1287–1295
Year: 2015
DOI: https://doi.org/10.1021/bi501481n

2012

A fast chemoenzymatic synthesis of [¹¹C]‑N⁵,N¹⁰‑methylenetetrahydrofolate as a potential PET tracer for proliferating cells Authors: Muhammad Saeed, Timothy J. Tewson, Colbin E. Erdahl, Amnon Kohen Journal: Nuclear Medicine and Biology 39(5), 697–701
Publication Date: July 15, 2012
DOI:https://doi.org/10.1016/j.nucmedbio.2011.12.003

A fast chemoenzymatic synthesis of [11C]‑N5,N10‑methylenetetrahydrofolate as a potential PET tracer for proliferating cells
Authors: Muhammad Saeed, T.J. Tewson, C.E. Erdahl, Amnon Kohen
Journal: Nuclear Medicine and Biology 39(5), 697–701
DOI:https://doi.org/10.1016/j.nucmedbio.2011.12.003

Effect of tumour necrosis factor‑alpha on estrogen metabolic pathways in breast cancer cells
Authors: M. Kamel, S. Shouman, M. El‑Merzebany, G. Kilic, T. Veenstra, Muhammad Saeed, …
Journal: Journal of Cancer 3, 310–319


Mechanism of DNA depurination by carcinogens in relation to cancer initiation
Authors: Ercole Cavalieri, Muhammad Saeed, M. Zahid, D. Cassada, D. Snow, M. Miljkovic, …
Journal: IUBMB Life 64(2), 169–179
DOI: https://doi.org/10.1002/iub.58

 2011

Formation of dopamine quinone‑DNA adducts and their potential role in the etiology of Parkinson’s disease
Authors: M. Zahid, Muhammad Saeed, L. Yang, C. Beseler, E. Rogan, E.L. Cavalieri
Journal: IUBMB Life 63(12), 1087–1093
DOI: https://doi.org/10.1002/iub.538

Formation of diethylstilbestrol–DNA adducts in human breast epithelial cells and inhibition by resveratrol
Authors: B. Hinrichs, M. Zahid, Muhammad Saeed, M.F. Ali, E.L. Cavalieri, E.G. Rogan
Journal: Journal of Steroid Biochemistry and Molecular Biology 127(3–5), 276–281
DOI: https://doi.org/10.1016/j.jsbmb.2011.03.012 (doi.org in Bing)

Novel positron emission tomography tracer distinguishes normal from cancerous cells
Authors: Muhammad Saeed, D. Sheff, Amnon Kohen
Journal: Journal of Biological Chemistry 286(39), 33872–33878
DOI: https://doi.org/10.1074/jbc.M111.275446

The effect of tamoxifen and raloxifene on estrogen metabolism and endometrial cancer risk
Authors: M.Y. Williams‑Brown, S.M. Salih, X. Xu, T.D. Veenstra, Muhammad Saeed, S.K. Theiler, …
Journal: Journal of Steroid Biochemistry and Molecular Biology 126(3–5), 78–86
DOI:https://doi.org/10.1016/j.jsbmb.2011.03.010

Resveratrol and N‑acetylcysteine block the cancer‑initiating step in MCF‑10F cells
Authors: M. Zahid, Muhammad Saeed, C. Beseler, E.G. Rogan, E.L. Cavalieri
Journal: Free Radical Biology and Medicine 50(1), 78–85
DOI: https://doi.org/10.1016/j.freeradbiomed.2010.10.701


                          




what we do

The Bioorganic & Medicinal Chemistry (BMC) group focuses on advancing research in organic synthesis, medicinal chemistry, and drug discovery. Our work spans from designing new molecules and polymers to interpreting NMR spectra and exploring innovative approaches in chemical education. We combine laboratory research with computational tools and science communication to train the next generation of chemists and contribute to solving real‑world challenges.

Research Expertise

Advancing synthetic organic chemistry, medicinal chemistry, and drug discovery.

Student Training

Guiding undergrad and graduate students in synthesis, computational design, and lab skills

Collaborations

Working with academia and industry to develop smart therapeutic solutions.

Publications & Outreach

Sharing discoveries through journals, conferences, and science communication.

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