Publications

2025

• Sruthi Peesapati, Sandipan Chakraborty* (2025). Altered Composition of Ceramides and Sphingomyelin Distinctly Modulates the Organizational Landscape and Microdomain Dynamics of Neuronal Plasma Membrane: A Computational Microscopy of Alzheimer’s Brain. 16, 13, 2473–2484. DOI: https://doi.org/10.1021/acschemneuro.5c00261

• Ganguly, Saptarnab*, Tandrika Chattopadhyay*, Rubina Kazi, Souparno Das, Bhavisha Malik, Uthpala Ml, Padmapriya S. Iyer et al., (2025). Consumption of sucrose-water rewires macronutrient uptake and utilization mechanisms in a tissue specific manner. The Journal of Nutritional Biochemistry 139: 09850. DOI: https://doi.org/10.1016/j.jnutbio.2025.109850

• Suman Singh, Farhan Ahmed, Naireen Fatima, Cholleti Sai Nikhith, Harshavardhan Bhuktar, Rafiq Ahmad Khan, Sumbul Afroz, Srikanth Battu, Kakularam Kumar Reddy, Manaswani Jagadeb, Saima Naz, Neha Sharma, Aradhan Mariam Philips, Tina Priscilla, Vaibhav Vindal, M Jerald Mahesh Kumar, Srinivas Oruganti, Manojit Pal, Pallu Reddanna, Nooruddin Khan (2025). ALOX12B overexpression in the skin drives inflammasome/Th17 signaling axis to promote inflammation in the mouse model and human patients. bioRxiv. DOI: https://doi.org/10.1101/2025.06.09.658245

• Intisar Al Fahdi, Swati Singh, Krishnaveni Yadavalli, Kiranam Chatti, Gandham SriLakshmi Bhavani, Katta M. Girisha (2025). ARSK-Related Mucopolysaccharidosis Type 10. American Journal of Medical Genetics Part A, 0:e64210. DOI: https://doi.org/10.1002/ajmg.a.64210

• Deepesh Biswas, Rebecca Kristina Edwin, K. Shiva Kumar, Anwar Alam, Dhiraj Kumar, Sandipan Chakraborty, Gopalakrishnan Bulusu, Farhan Jalees Ahmad, Gautham G. Shenoy, Lakshyaveer Singh, Mansi Agarwal, Fouzia Siraj, Srinivas Oruganti, Parimal Misra, Nasreen Zafar Ehtesham, Manojit Pal, Seyed Ehtesham Hasnain (2025). Early preclinical development of Mycobacterium tuberculosis amino acid biosynthesis pathway inhibitor DRILS-1398 as a potential anti-TB drug, iScience, Volume 28, Issue 6, 112537.

• Shetty, Manasa Gangadhar and Dey, Bipasa and Pai, Padmini and Rao, Pallavi and Nayak, Usha Yogendra and Ashwini, T and Oruganti, Srinivas and Satyamoorthy, Kapaettu and Sundara, Babitha Kampa (2025). Identification of a Novel Dual Hdac/Rr Inhibitor as a Promising Anticancer Agent. Available at SSRN: https://ssrn.com/abstract=5236357  or  http://dx.doi.org/10.2139/ssrn.5236357

• Kandettu A., Yeole M., Sekar H., Garapati K., Kaur N., Anand A., Hegde P., Nair K., Medishetti R., Bhat V., Radhakrishnan P., Mundkur S.C., Shrikiran H.A., Pandey A., Sevilimedu A., Chakrabarty S., Shukla A (2025). Further delineation of defects in MRPS2 causing human OXPHOS deficiency and early developmental abnormalities in zebrafish. European Journal of Human Genetics. DOI: https://doi.org/10.1038/s41431-025-01858-1.

• Biswas D, Edwin RK, Kumar KS, Alam A, Kumar D, Chakraborty S, Bulusu G, Ahmad FJ, Shenoy GG, Singh L, Agarwal M, Siraj F, Oruganti S, Misra P, Ehtesham NZ, Pal M, Hasnain SE (2025). Early preclinical development of Mycobacterium tuberculosis amino acid biosynthesis pathway inhibitor DRILS-1398 as a potential anti-TB drug, ISCIENCE, DOI: https://doi.org/10.1016/j.isci.2025.112537

• Swati Singh., Sumita Danda., Neetu Sharma, Hitesh Shah, Vrisha Madhuri, Tariq Altaf Mir, Nadia Zipporah Padala, Raghavender Medishetti, Alka Ekbote, Gandham SriLakshmi Bhavani, Aarti Sevilimedu, Katta M. Girisha (2025). Biallelic variants in CCN2 underlie an autosomal recessive kyphomelic dysplasia. European Journal of Human Genetics. DOI: https://doi.org/10.1038/s41431-024-01725-5

• Rao Pallavi, Rudrakshula Madhavachary, Potham Rajendar, Katari Rahul Varma, Reddy Eda, Vishnuvardhana Vema, Sen Saikat, Oruganti Srinivas (2025). Unified synthesis of DSPC and PSPC: Chemical entities of hydrogenated soy L-α-phosphatidylcholine (HSPC), a key component of liposomal drug formulations. Tetrahedron Letters, 155: 155424.

• Varshini Uma Jayaraman, Raghavender Medishetti, Shreetama Ghosh, Kiranam Chatti, Mahesh Kumar Uppada, Srinivas Oruganti (2025). Leveraging transfer learning for high-accuracy phenotypic screening in zebrafish image analysis. bioRxiv preprint doi: https://doi.org/10.1101/2025.01.21.634041

• Swathi C, Payal Chaubey, Sunny Khandelwal, Raghavender Medishetti, Sushreeta Chakraborty, Shruthi Rajaram, Kavya Jayakumar, Pikaso Latua, Rythem Goyal, R Gopalakrishna, Sougat Das, Kiranam Chatti, Kalyaneswar Mandal, Aneesh Tazhe Veetil (2025). GPCR-targeted imaging and manipulation of homeostatic microglia in living systems. bioRxiv preprint doi: https://doi.org/10.1101/2025.04.01.646501

• Swati Singh, Sumita Danda, Neetu Sharma, Hitesh Shah, Vrisha Madhuri, Tariq Altaf Mir, Nadia Zipporah Padala, Raghavender Medishetti, Alka Ekbote, Gandham SriLakshmi Bhavani, Aarti Sevilimedu, Katta M. Girisha (2025). Biallelic variants in CCN2 underlie an autosomal recessive kyphomelic dysplasia. European Journal of Human Genetics, 33 (1): 30-37. DOI: 10.1038/s41431-024-01725-5.

• Mathew JA, Paul G, Jacob J, Janesh Kumar, Neelima Dubey, Ninan Sajeeth Philip (2025). A new robust AI/ML based model for accurate forensic age estimation using DNA methylation markers. Forensic Science, Medicine and Pathology. https://doi.org/10.1007/s12024-025-00985-x

• Anushka Arvind, Sreelekshmi S, Neelima Dubey (2025). Genetic, Epigenetic, and Hormonal Regulation of Stress Phenotypes in Major Depressive Disorder: From Maladaptation to Resilience. Cellular and Molecular Neurobiology, 45:29. DOI: https://link.springer.com/article/10.1007/s10571-025-01549-x

2024

• Biswas Arunangshu, Rao Pallavi, Shinde Manish, Veeramani Karuna, Wagh Kanchan, Oruganti Srinivas (2024). Delineating a greener synthesis of a key sartan intermediate by photochemical benzylic bromination with electrochemically generated bromine. ChemRxiv. DOI: https://doi.org/10.26434/chemrxiv-2024-7kjj7-v2

• Thalla Haripriya, Uma Jayaraman Varshini, Uppada Maheshkumar, Eda Vishnuvardhan Reddy, Sen Saikat, Bandichhor Rakeshwar, Oruganti Srinivas (2024). Supervised Machine-Learning Algorithm using Low Data Sets: Flow Chemistry Optimization of the Key Urea Moiety Construction in Larotrectinib. Organic Process Research & Development, 28 (7): 2552-2560.

• Veeramani Karuna, Shinde Manish, Eda Vishnuvardhana Vema Reddy, Peraka Swamy, Mohan Saranya, Bandichhor Rakeshwar, Oruganti Srinivas (2024). Investigation into a high-p,T,c continuous flow synthesis of myristyl-γ-picolinium chloride (MGPC) – a preservative in pharmaceutical formulations. Journal of Flow Chemistry, 14 (2): 481-489.

• Patel Kashyap, Kapdi Anant R, Shinde Manish Manohar, Veeramani Karuna, Oruganti Srinivas (2024). Continuous flow multigram-scale synthesis of cetylpyridinium chloride. Sustainability & Circularity NOW, 01.

• Rabindra Nath Pradhan, Suvam Kumar Panda, Julia Torres, Carlos Kremer, Shrutika Kavali, Neelima Dubey, Suprava Naik, Akhilesh Kumar Singh. A mono-aquated di-pyridine-based Gd(III) complex as T1-weighted MRI probe with high relaxivity and stability (2024) Inorganica Chimica Acta, 561: 121845. DOI: https://doi.org/10.1016/j.ica.2023.121845

• Harshavardhan Bhuktar, B., Thirupataiah, Guntipally Mounika, Snigdha Samarpita, Arulkumaran Rithvik, S.V.S., Sasi Priya, Roumi Naskar, Raghavender Medishetti, Jagadish, P.C., Kishore V.L. Parsa, Mahaboobkhan Rasool, Sandipan Chakraborty, Manojit Pal. Targeting next-generation PDE4 inhibitors in search of potential management of rheumatoid arthritis and psoriasis (2024) Bioorganic Chemistry, 107689. DOI: https://doi.org/10.1016/j.bioorg.2024.107689.

• Rambabu Dandela, Manojit Pal. Organic Chemistry-Biology Interface research activities in India (2024) Bioorganic Chemistry, 108031. DOI: https://doi.org/10.1016/j.bioorg.2024.108031.

• Hilal Ahmad Reshi, Raghavender Medishetti, Aishwarya Ahuja, Deepa Balasubramanian, Kavita Babu, Manish Jaiswal, Kiranam Chatti, Subbareddy Maddika (2024). EYA protein complex is required for Wntless retrograde trafficking from endosomes to Golgi. Developmental Cell, 59(18): 2443-2459. doi: 10.1016/j.devcel.2024.05.021

• Swati Singh., Sumita Danda., Neetu Sharma, Hitesh Shah, Vrisha Madhuri, Tariq Altaf Mir, Nadia Zipporah Padala, Raghavender Medishetti, Alka Ekbote, Gandham SriLakshmi Bhavani, Aarti Sevilimedu, Katta M. Girisha. Biallelic variants in CCN2 underlie an autosomal recessive kyphomelic dysplasia European Journal of Human Genetics. DOI: https://doi.org/10.1038/s41431-024-01725-5

• Rita Rani, Sushma N., Raghavender Medishetti, Kiranam Chatti, Aarti Sevilimedu. Loss of FMRP affects ovarian development and behaviour through multiple pathways in a zebrafish model of fragile X syndrome (2024) Human Molecular Genetics, 33:16, 1391-1405. DOI: 10.1093/hmg/ddae077.

• Galande S., Verma A., Mall R., Parsa K.V., Tokala R.K., Bynigeri R., Pondugala P.K., Vemula K., Latha S.S., Sowpati D.T., Singh S.S., Rao G.V., Talukdar R., Kanneganti T.D., Reddy D.N., Sasikala M. Modulation of nuclear receptor 4A1 expression improves insulin secretion in a mouse model of chronic pancreatitis (2024) Pancreas, 53 (9): 6760-e773. DOI: 10.1097/MPA.0000000000002370.

• Bauri R., Bele S., Edelli J., Reddy N.C., Kurukuti S., Devasia T., Ibrahim A., Rai V., Mitra P. Reduced Incretin Receptor trafficking upon activation enhances glycemic control and reverses obesity in diet-induced obese mice (2024) Americal Journal of Physiology-Cell Physiology, 327 (1): C74-C96. DOI: 10.1152/ajpcell.00474.2023.

• Shashikant Patel, Venkatesh Govindarajan, Sumana Chakravarty, Neelima Dubey. From blood to brain: Exploring the role of fibrinogen in the pathophysiology of depression and other neurological disorders (2024) International Immunopharmacology, 143: 113326. Doi: https://doi.org/10.1016/j.intimp.2024.113326

• Nag M, Pallavi J, Chakraborty S, Roychoudhury T, Mondal S, Ghosh A, Saha C, Banerjee M, Seal A. Bacterial endosymbionts of a nitrogen-fixing yeast Rhodotorula mucilaginosa JGTA-S1 – insights into a yet unknown micro-ecosystem (2024) Molecular Omics, doi: 10.1039/d3mo00273j.

• Hosamani, S., Chakraborty, S. Cholesterol Allosterically Modulates the Structure and Dynamics of the Taurocholate Export Pump (ABCB11) (2024) The Journal of Physical Chemistry Letters, 15: 7901-7908. doi: 10.1021/acs.jpclett.4c01341

• Shukla, S., Sarkar, K., Biswas, D., Bhuktar, H., Giliyaru, V.B., Chakraborty, S., Oruganti, S., Misra, P., Pal, M. An inexpensive, metal-free and one-pot approach towards N-sulfonyl amidines: Identification of a chorismate mutase inhibitor with activities against S. aureus (2024) Journal of Molecular Structure, 1312. DOI: 10.1016/j.molstruc.2024.138531

• Kotakommula, H., Chintala, V., Nannapaneni, S.S., Katari, N.K., Kapavarapu, R., Pal, M. In(OTf)3 promoted sonochemical approach to 3-(2-chloropyrimidin-4-yl) indoles: Their in silico and in vitro evaluation against SIRT1 (2024) Journal of Molecular Structure, 1311. DOI: 10.1016/j.molstruc.2024.138471

• Addu, N., Miriyala, H., Kapavarapu, R., Kolli, S.K., Pal, M. N-Unsubstituted 1,2-benzothiazine 1,1-dioxides: Pd-catalyzed one-pot sonochemical access and in silico / in vitro evaluation against MtbCM (2024) Journal of Molecular Structure, 1301. DOI: 10.1016/j.molstruc.2023.137345

• Surekha, B., Misra, P., Thippaiah, A.C., Shamanna, B.R., Madathil, A., Rajadurai, M.A microneedle transdermal patch loaded with iron(ii) nanoparticles for non-invasive sustained delivery to combat anemia (2024) Materials Advances, 5 (8), pp. 3247-3256. DOI: 10.1039/d3ma01166f

• Chemboli, R., Tej Mandava, B., Sai Kodali, U., Kumar Taneja, A., Tej Mandava, B., Sesha Sri Chandana, O., Sultana, M.S., Yarlagadda, B., Prasad, K.R.S., Venkata Basaveswara Rao, M., Pal, M. A sonochemical approach to 4-substituted pyrrolo[1,2-a] quinoxalines via Cu-catalyzed N-arylation followed by Wang resin/air promoted oxidative cyclization strategy (2024) Tetrahedron Letters, 136. DOI: 10.1016/j.tetlet.2024.154917

• Chemboli, R., Kodali, U.S., Taneja, A.K., Bandaru, V., Mandava, B.T., Suryadevara, V., Mandava, B.T., Prasad, K.R.S., Kapavarapu, R., Rao, M.V.B., Pal, M. Sonochemical replacement of C-3 hydrogen of indole by a pyridine ring: Docking, synthesis and in vitro evaluation of 3-(6-aryl pyridin-2-yl) indoles against SIRT1 (2024) Journal of Molecular Structure, 1298. DOI: 10.1016/j.molstruc.2023.137025

• Prasada Rao, D.E., Bhuvan Tej, M., Raju, M.D., Kumar Reddy, N.R., Bhagya Tej, M., Rajendiran, C., Rao Vasireddy, P.C., Kapavarapu, R., Pal, P., Basaveswara Rao, M.V., Pal, M. In Silico Evaluation of 1-Aminoisoquinoline Derivatives against Dengue Virus: Greener Access via a Sonochemical Method (2024) Chemistry Select, 9 (4). DOI: 10.1002/slct.202304384

• Kotakommula, H., Chintala, V., Nannapaneni, S.S., Katari, N.K., Kapavarapu, R., Pal, M. Wang resin catalyzed sonochemical synthesis of 2-amino-3,5-dicarbonitrile-6-thio-pyridines as potential inhibitors of SIRT1 (2024) Journal of Molecular Structure, 1295. DOI: 10.1016/j.molstruc.2023.136756

• Saha, C., Naskar, R., Chakraborty, S. Antiviral Flavonoids: A Natural Scaffold with Prospects as Phytomedi-cines against SARS-CoV2 (2024) Mini-Reviews in Medicinal Chemistry, 24 (1), pp. 39-59, DOI: 10.2174/1389557523666230503105053

• Edwin, R.K., Acharya, L.P., Maity, S.K., Chakrabarti, P., Tantia, O., Joshi, M.B., Satyamoorthy, K., Parsa, K.V.L., Misra, P. TGS1/PIMT knockdown reduces lipid accumulation in adipocytes, limits body weight gain and promotes insulin sensitivity in mice (2024) Biochimica et Biophysica Acta – Molecular Basis of Disease, 1870 (1). DOI: 10.1016/j.bbadis.2023.166896

• Challa, N.L., Sarkar, A., Kapettu, S., Phanithi, P.B., Chakrabarti, P., Parsa, K.V.L., Misra, P. TGS1/PIMT regulates pro-inflammatory macrophage mediated paracrine insulin resistance: Crosstalk between macrophages and skeletal muscle cells (2024) Biochimica et Biophysica Acta – Molecular Basis of Disease, 1870 (1). DOI: 10.1016/j.bbadis.2023.166878

2023

• Addu, N., Miriyala, H., Kapavarapu, R., Kolli, S.K., Pal, M. Synthesis, Docking and In Vitro Evaluation of Spiroindoline-3,2’-Quinazoline Derivatives (2023) Chemistry Select, 8 (45). DOI: 10.1002/slct.202302793

• Rao, G.V.N., Taneja, A.K., Tej, M.B., Sri, K.N., Vijayavardhini, S., Dandamudi, S., Chinnamaneni, S.V., Kapavarapu, R., Rao, M.V.B., Pal, M. Sonochemical synthesis, docking studies and in vitro evaluation of imidazo-1,3-oxazinone derivatives as potential inhibitors of TNF-α (2023) Journal of Molecular Structure, 1292. DOI: 10.1016/j.molstruc.2023.136239

• Adapa, S., Kodali, U.S., Taneja, A.K., Bandaru, V., Mandava, B.T., Balakrishna, B., Mandava, B.T., Panigrahi, N., Rao, M.V.B., Pal, M. Ultrasound assisted synthesis of 4-(1H-indol-3-yl) thieno[2,3-d]pyrimidine derivatives via AcOH mediated C [sbnd]C bond forming reaction (2023) Tetrahedron Letters, 131. DOI: 10.1016/j.tetlet.2023.154784

• Dhananjaya, G., Venkateshwarlu, R., Madhubabu, M.V., Raghunadh, A., Murthy, V.N., Reddy, S.P., Anna, V.R., Kapavarapu, R., Pal, M. Synthesis of 2,3-dihydroquinazolin-4(1H)-one derivatives as potential inhibitors of TNF-α (2023) Journal of Molecular Structure, 1287. DOI: 10.1016/j.molstruc.2023.135668

• Medishetti, R., Mallikarjuna Rao, C., Chatti, K. Cabozantinib-induced edema in zebrafish represents an adverse effect characterized by defects in lymphatic vasculature and renal function (2023) Journal of Biochemical and Molecular Toxicology, 37 (9). DOI: 10.1002/jbt.23413

• Bhuktar, H., Shukla, S., Kakularam, K.R., Battu, S., Srikanth, M., Srivastava, S., Medishetti, R., Ram, P., Jagadish, P.C., Rasool, M., Chakraborty, S., Khan, N., Reddanna, P., Oruganti, S., Pal, M. Design, synthesis and evaluation of 2-aryl quinoline derivatives against 12R-lipoxygenase (12R-LOX): Discovery of first inhibitor of 12R-LOX (2023) Bioorganic Chemistry, 138. DOI: 10.1016/j.bioorg.2023.106606

• Rao, G.V.N., Dandamudi, S., Tej, M.B., Chinnamaneni, S.V., Vasireddy, P.C.R., Kapavarapu, R., Rao, M.V.B., Pal, M. A sonochemical approach to 3-(het)aryl substituted 1H-[1,3]oxazino[3,4-a]indol-1-one derivatives promoted by Pd/Cu-catalysts and ZnCl2 (2023) Tetrahedron Letters, 126. DOI: 10.1016/j.tetlet.2023.154659

• Chandra, K., Swathi, M., Keerthana, B., Gopan, S., Ghantasala, J.P., Joshi, M.B., Thondamal, M., Parsa, K.V.L. PHLPP1 regulates PINK1-parkin signalling and life span (2023) Biochimica et Biophysica Acta – Molecular Basis of Disease, 1869 (6). DOI: 10.1016/j.bbadis.2023.166718

• Addu, N., Miriyala, H., Kapavarapu, R., Kolli, S.K., Pal, M. Wang-OSO3H catalyzed one-pot sonochemical synthesis of 1,2,4-benzothiadiazine-1,1-dioxide derivatives: Their in silico / in vitro assessments against MtbCM (2023) Journal of Molecular Structure, 1283. DOI: 10.1016/j.molstruc.2023.135313

• Manikanttha, M., Deepti, K., Tej, M.B., Tej, M.B., Gopi Reddy, A., Kapavarapu, R., Barange, D.K., V Basaveswara Rao, M., Pal, M. Ultrasound assisted Cu-catalyzed Ullmann-Goldberg type coupling-cyclization in a single pot: Synthesis and in silico evaluation of 11H-pyrido[2,1-b] quinazolin-11-ones against SARS-CoV-2 RdRp (2023) Journal of Molecular Structure, 1280. DOI: 10.1016/j.molstruc.2023.135044

• Shukla, S., Nishanth Rao, R., Bhuktar, H., Edwin, R.K., Jamma, T., Medishetti, R., Banerjee, S., Giliyaru, V.B., Shenoy, G.G., Oruganti, S., Misra, P., Pal, M. Wang resin catalysed sonochemical synthesis of pyrazolo[4,3-d]pyrimidinones and 2,3-dihydroquinazolin-4(1H)-ones: Identification of chorismate mutase inhibitors having effects on Mycobacterium tuberculosis cell viability (2023) Bioorganic Chemistry, 134. DOI: 10.1016/j.bioorg.2023.106452

• Sangepu, V.R., Jain, K.K., Bhoomireddy, R.D., Sharma, D., Venkateshwarlu, R., Kapavarapu, R., Dandela, R., Pal, M. One-pot sonochemical synthesis and in silico/in vitro antitubercular evaluation of 1-methyl-3-propyl-1H-pyrazole containing polynuclear fused N-heteroarenes (2023) Journal of Molecular Structure, 1278, art. no. 134909. DOI: 10.1016/j.molstruc.2023.134909

• Kapadia, B., Behera, S., Kumar, S.T., Shah, T., Edwin, R.K., Babu, P.P., Chakrabarti, P., Parsa, K.V.L., Misra, P. PIMT regulates hepatic gluconeogenesis in mice (2023) iScience, 26 (3). DOI: 10.1016/j.isci.2023.106120

• Kondabanthini, S., Akshinthala, P., Katari, N.K., Srimannarayana, M., Gundla, R., Kapavarapu, R., Pal, M. A rapid synthesis of 5-substituted 7-amino-6-cyano-1,5-dihydro-1H-pyrano[2,3-d] pyrimidine-2,4(3H)-diones and their in silico / in vitro evaluation against SIRT1 (2023) Journal of Molecular Structure, 1276. DOI: 10.1016/j.molstruc.2022.134753

• Veeramani, K., Shinde, M., Eda, V.V.R., Darapaneni, B.C., Hindupur, R.M., Madarapu, S.R., Sen, S., Oruganti, S. Alternate end-game strategies towards Nirmatrelvir synthesis: Defining a continuous flow process for the preparation of an anti-COVID drug (2023) Tetrahedron Letters, 116. DOI: 10.1016/j.tetlet.2023.154344

• Sangepu, V.R., Sharma, D., Venkateshwarlu, R., Bhoomireddy, R.D., Jain, K.K., Kapavarapu, R., Dandela, R., Pal, M. In silico studies, sonochemical synthesis and biological evaluation of 4-substituted pyrimido[1,2-b] indazoles (2023) Journal of Molecular Structure, 1273. DOI: 10.1016/j.molstruc.2022.134273

• Ramarao, S., Pothireddy, M., Venkateshwarlu, R., Moturu, K.M.V., Siddaiah, V., Kapavarapu, R., Dandela, R., Pal, M. A rapid construction of 4(3H)-quinazolinone and related ring under ultrasound irradiation: In silico/in vitro studies of compounds synthesized (2023) Journal of Molecular Structure, 1273. DOI: 10.1016/j.molstruc.2022.134280

• Garrepalli, S., Gudipati, R., Kapavarapu, R., Ravindhranath, K., Pal, M. Synthesis and characterization of two known and one new impurities of dolutegravir: In silico evaluation of certain intermediates against SARS CoV-2 O-ribose methyltransferase (OMTase) (2023) Journal of Molecular Structure, 1271. DOI: 10.1016/j.molstruc.2022.133992

• Rani, R., Parsa, K.V.L., Chatti, K., Sevilimedu, A. An efficient and cost-effective method for directed mutagenesis at multiple dispersed sites – a case study with Omicron Spike DNA (2023) Biology Methods and Protocols, 8 (1). DOI: 10.1093/biomethods/bpac037

• Krishnan, S.R., Bung, N., Padhi, S., Bulusu, G., Misra, P., Pal, M., Oruganti, S., Srinivasan, R., Roy, A. De novo design of anti-tuberculosis agents using a structure-based deep learning method (2023) Journal of Molecular Graphics and Modelling, 118. DOI: 10.1016/j.jmgm.2022.108361

2022

• Sampath Magesh, Jayaraman Sembian Ruso, Eda Vishnuvardhan Reddy, Potham Rajendar, Budhdev Rajeev Rehani, Sen Saikat, Bandichhor Rakeshwar, Oruganti Srinivas (2022). Enantioselective Synthesis of the Chiral Pyrrolidine Fragment of Upadacitinib via Chiral Auxiliary Directed Diastereoselective 1,3-Dipolar Cycloaddition. Organic Process Research & Development, 26 (6): 1794-1802.

• Balamurugan, K., Medishetti, R., Rao, P., K, R.V., Chatti, K., Parsa, K.V.L. Protocol to evaluate hyperlipidemia in zebrafish larvae (2022) STAR Protocols, 3 (4). DOI: 10.1016/j.xpro.2022.101819

• Medishetti, R., Balamurugan, K., Yadavalli, K., Rani, R., Sevilimedu, A., Challa, A.K., Parsa, K., Chatti, K. CRISPR-Cas9-induced gene knockout in zebrafish (2022) STAR Protocols, 3 (4). DOI: 10.1016/j.xpro.2022.101779

• Sandeep Kumar, J., Naimisha, R., Thirupataiah, B., Sujeevan Reddy, G., Bung, N., Roy, A., Bulusu, G., Mishra, A., Yadav, P.N., Misra, P., Pal, M. Sonochemical synthesis and biological evaluation of isoquinolin-1(2H)-one/isoindolin-1-one derivatives: Discovery of a positive ago-allosteric modulator (PAAM) of 5HT2CR (2022) Bioorganic Chemistry, 129. DOI: 10.1016/j.bioorg.2022.106202

• Sujeevan Reddy, G., Sandeep Kumar, J., Thirupataiah, B., Bhuktar, H., Shukla, S., Pal, M. Recent advances in transition metal-catalyzed reactions of chloroquinoxalines: Applications in bioorganic chemistry (2022) Bioorganic Chemistry, 129. DOI: 10.1016/j.bioorg.2022.106195

• Sangepu, V.R., Sharma, D., Venkateshwarlu, R., Bhoomireddy, R.D., Jain, K.K., Dandela, R., Pal, M. Ultrasound Assisted α-Arylation of Ketones: A Rapid Access to Isoquinolinone Derivatives (2022) Chemistry Select, 7 (40). DOI: 10.1002/slct.202202710

• Kondabanthini, S., Katari, N.K., Srimannarayana, M., Gundla, R., Kapavarapu, R., Pal, M. Wang resin catalyzed sonochemical synthesis of dihydropyrano[2,3-c]pyrazole derivatives and their interactions with SIRT1 (2022) Journal of Molecular Structure, 1266. DOI: 10.1016/j.molstruc.2022.133527

• Balamurugan, K., Chandra, K., Sai Latha, S., Swathi, M., Joshi, M.B., Misra, P., Parsa, K.V.L. PHLPPs: Emerging players in metabolic disorders (2022) Drug Discovery Today, 27 (10), art. no. 103317. DOI: 10.1016/j.drudis.2022.07.002

• Reddy, G.S., Shukla, S., Bhuktar, H., Hossain, K.A., Edwin, R.K., Giliyaru, V.B., Misra, P., Pal, M. Pd/Cu-catalyzed access to novel 3-(benzofuran-2-ylmethyl) substituted (pyrazolo/benzo)triazinone derivatives: their in silico/in vitro evaluation as inhibitors of chorismate mutase (CM) (2022) RSC Advances, 12 (41), pp. 26686-26695. DOI: 10.1039/d2ra05255e

• Manikanttha, M., Deepti, K., Tej, M.B., Reddy, A.G., Kapavarapu, R., Rao, M.V.B., Pal, M. Wang resin catalyzed green synthesis of 1,8-dioxo-octahydroxanthene derivatives and their in silico/in vitro evaluation against SIRT1 (2022) Journal of Molecular Structure, 1264. DOI: 10.1016/j.molstruc.2022.133313

• Edwin, R.K., Challa, N., Sharma, R., Satyamoorthy, K., Parsa, K., Misra, P. PIMT/TGS1: An evolving metabolic molecular switch with conserved methyl transferase activity (2022) Drug Discovery Today, 27 (8), pp. 2386-2393. DOI: 10.1016/j.drudis.2022.04.018

• Vijaykumar, B.V.D., Nalluri, S., Uppada, M.K., Sen, S., Ulla, H., Krishnamanohara, Kamaja, C.K., Balakrishnan, M., Katiyar, M., Oruganti, S. Ligand-Free Suzuki Coupling for the Practical Synthesis of 4-(Triphenylen-2-yl) dibenzothiophene for Solution-Processed OLEDs (2022) Chemistry Select, 7 (25). DOI: 10.1002/slct.202104153

• Kumar, J.S., Reddy, G.S., Medishetti, R., Amirul Hossain, K., Thirupataiah, B., Edelli, J., Dilip Bele, S., Kristina Edwin, R., Joseph, A., Shenoy, G.G., Mallikarjuna Rao, C., Pal, M. Ultrasound assisted one-pot synthesis of rosuvastatin based novel azaindole derivatives via coupling–cyclization strategy under Pd/Cu-catalysis: Their evaluation as potential cytotoxic agents (2022) Bioorganic Chemistry, 124. DOI: 10.1016/j.bioorg.2022.105857

• Ramarao, S., Pothireddy, M., Venkateshwarlu, R., Moturu, K.M.V., Siddaiah, V., Dandela, R., Pal, M. Cu(OAc)2 catalyzed ultrasound assisted rapid synthesis of isocoumarin derivatives bearing 3-oxobutyl moiety at C-4 position (2022) Journal of Molecular Structure, 1254. DOI: 10.1016/j.molstruc.2022.132418

• Challa, C.S., Katari, N.K., Nallanchakravarthula, V., Nayakanti, D., Kapavarapu, R., Pal, M. Wang-OSO3H catalyzed green synthesis of 2-arylamino-3-cyanopyridine derivatives under ultrasound: Their assessment as potential inhibitors of SIRT1 (2022) Journal of Molecular Structure, 1253. DOI: 10.1016/j.molstruc.2021.132309

• Garrepalli, S., Gudipati, R., Amasa, S.R., Ravindhranath, K., Pal, M. Synthesis of two diastereomeric impurities of a fluorinated antiretroviral drug dolutegravir (2022) Journal of Molecular Structure, 1253. DOI: 10.1016/j.molstruc.2021.132274

• Thirupataiah, B., Bhuktar, H., Mounika, G., Reddy, G.S., Kumar, J.S., Shukla, S., Hossain, K.A., Medishetti, R., Samarpita, S., Rasool, M., Jagadish, P.C., Shenoy, G.G., Parsa, K.V.L., Pal, M. Fe(III)-catalyzed regioselective and faster synthesis of isocoumarins with 3-oxoalkyl moiety at C-4: Identification of new inhibitors of PDE4 (2022) Bioorganic Chemistry, 121, art. no. 105667. DOI: 10.1016/j.bioorg.2022.105667

• Kumar V, J., Banu, S., Sasikala, M., Parsa, K.V.L., Sowpati, D.T., Yadav, R., Tallapaka, K.B., Siva, A.B., Vishnubhotla, R., Rao, G.V., Reddy, D.N. Effectiveness of REGEN-COV antibody cocktail against the B.1.617.2 (delta) variant of SARS-CoV-2: A cohort study (2022) Journal of Internal Medicine, 291 (3), pp. 380-383. DOI: 10.1111/joim.13408

• Balamurugan, K., Medishetti, R., Kotha, J., Behera, P., Chandra, K., Mavuduru, V.A., Joshi, M.B., Samineni, R., Katika, M.R., Ball, W.B., Thondamal, M., Challa, A., Chatti, K., Parsa, K.V.L. PHLPP1 promotes neutral lipid accumulation through AMPK/ChREBP-dependent lipid uptake and fatty acid synthesis pathways (2022) iScience, 25 (2). DOI: 10.1016/j.isci.2022.103766

• Dhananjaya, G., Venkateshwarlu, R., Dinne, N.K.R., Kumar, A.M., Mekala, R., Anna, V.R., Kapavarapu, R., Pal, M. Wang-OSO3H catalyzed green synthesis of bioactive isoidolo[2,1-a] quinazoline-5,11 dione derivatives: An unexpected observation (2022) Journal of Molecular Structure, 1250. DOI: 10.1016/j.molstruc.2021.131922

• Chemboli, R., Prasad, K.R.S., Rao, P.R., Kumar, A.V.D.N., Tej, M.B., Kapavarapu, R., Rao, M.V.B., Pal, M. Sonochemical synthesis of indolo[1,2-a]quinoxaline derivatives in the presence of Amberlyst-15: Their evaluation as potential cytotoxic agents (2022) Journal of Molecular Structure, 1250. DOI: 10.1016/j.molstruc.2021.131803

• Ganapathisivaraja, P., Rao, G.V.N., Ramarao, A., Tej, M.B., Praneeth, M.S., Kapavarapu, R., Rao, M.V.B., Pal, M. Ultrasound assisted Cu-catalyzed decarbonylative Sonogashira coupling-cyclization strategy: Synthesis and evaluation of 3-heteroarylmethylene isoindolin-1-ones against SIRT1 (2022) Journal of Molecular Structure, 1250. DOI: 10.1016/j.molstruc.2021.131788

• Samineni, R., Eda, V., Rao, P., Sen, S., Oruganti, S. Grignard Reagents as Niche Bases in the Synthesis of Pharmaceutically Relevant Molecules (2022) Chemistry Select, 7 (5), art. no. e202102853. DOI: 10.1002/slct.202102853

 

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