Computer-guided identification of novel inhibitors of apoptosis-signaling kinase 1 from Spondia mombim bioactive compounds against colorectal cancer

Chinnasamy S, Zameer F, Muthuchelian K (2020) Molecular and biological mechanisms of apoptosis and its detection techniques. J Oncol Sci 6(1):49–64

Article  Google Scholar 

Schram FR, Ng PKL (2012) What is cancer? J Crustac Biol 32(4):665–672

Article  Google Scholar 

El Nachef L, Bouchet A, Bourguignon M, Foray N (2024) When DNA mutations interplay with cellular proliferation: a narrative history of theories of carcinogenesis. Cancers (Basel) 16(11):2104

Article  PubMed  Google Scholar 

WHO - World Health Organization (2020) GLOBOCAN—colorectal cancer incidence in the world. Glob Cancer Observ 419:1–2

Google Scholar 

Ferlay J, Colombet M, Soerjomataram I, Parkin DM, Piñeros M, Znaor A et al (2021) Cancer statistics for the year 2020: an overview. Int J Cancer 149(4):778–789

Article  CAS  Google Scholar 

Xi Y, Xu P (2021) Global colorectal cancer burden in 2020 and projections to 2040. Transl Oncol 14(10):101174

Article  PubMed  PubMed Central  Google Scholar 

Morgan E, Arnold M, Gini A, Lorenzoni V, Cabasag CJ, Laversanne M et al (2023) Global burden of colorectal cancer in 2020 and 2040: incidence and mortality estimates from GLOBOCAN. Gut 72(2):338–344

Article  PubMed  Google Scholar 

Mármol I, Sánchez-de-Diego C, Dieste AP, Cerrada E, Yoldi MJR (2017) Colorectal carcinoma: a general overview and future perspectives in colorectal cancer. Int J Mol Sci 18(1):197

Article  PubMed  PubMed Central  Google Scholar 

Pretzsch E, Bösch F, Neumann J, Ganschow P, Bazhin A, Guba M et al (2019) Mechanisms of metastasis in colorectal cancer and metastatic organotropism: hematogenous versus peritoneal spread. J Oncol 2019:7407190

Article  PubMed  PubMed Central  CAS  Google Scholar 

Koveitypour Z, Panahi F, Vakilian M, Peymani M, Seyed Forootan F, Nasr Esfahani MH et al (2019) Signaling pathways involved in colorectal cancer progression. Cell Biosci 9(1):97

Article  PubMed  PubMed Central  Google Scholar 

Krall AS, Xu S, Graeber TG, Braas D, Christofk HR (2016) Asparagine promotes cancer cell proliferation through use as an amino acid exchange factor. Nat Commun 7:1–3

Article  Google Scholar 

Nguyen LH, Goel A, Chung DC (2020) Pathways of colorectal carcinogenesis. Gastroenterology 158(2):291–302

Article  PubMed  CAS  Google Scholar 

Malki A, Elruz RA, Gupta I, Allouch A, Vranic S, Al Moustafa AE (2021) Molecular mechanisms of colon cancer progression and metastasis: recent insights and advancements. Int J Mol Sci 22:1–24

Google Scholar 

Heppner DE, Eck MJ (2021) A structural perspective on targeting the <scp>RTK</scp> /Ras/ <scp>MAP</scp> kinase pathway in cancer. Protein Sci 30(8):1535–1553

Article  PubMed  PubMed Central  CAS  Google Scholar 

Hattori K, Naguro I, Runchel C, Ichijo H (2009) The roles of ASK family proteins in stress responses and diseases. Cell Commun Signal 7(1):9. https://doi.org/10.1186/1478-811X-7-9

Article  PubMed  PubMed Central  CAS  Google Scholar 

Papatsirou M, Artemaki PI, Karousi P, Scorilas A, Kontos CK (2021) Circular RNAs: emerging regulators of the major signaling pathways involved in cancer progression. Cancers (Basel) 13(11):2744

Article  PubMed  CAS  Google Scholar 

Han T, Gao J, Wang L, Qu Y, Sun A, Peng K, et al (2020) Original Article ASK1 inhibits proliferation and migration of lung cancer cells via inactivating TAZ. Am J Cancer Res 10. Available from: www.ajcr.us/

Nadel G, Maik-Rachline G, Seger R (2023) JNK cascade-induced apoptosis—a unique role in GqPCR signaling. Int J Mol Sci 24(17):13527

Article  PubMed  PubMed Central  CAS  Google Scholar 

Dyari HRE, Rawling T, Chen Y, Sudarmana W, Bourget K, Dwyer JM et al (2017) A novel synthetic analogue of ω-3 17,18-epoxyeicosatetraenoic acid activates TNF receptor-1/ASK1/JNK signaling to promote apoptosis in human breast cancer cells. FASEB J 31(12):5246–5257

Article  PubMed  CAS  Google Scholar 

Yin M, Zhou HJ, Zhang J, Lin C, Li H, Li X, et al (2017) ASK1-dependent endothelial cell activation is critical in ovarian cancer growth and metastasis. JCI Insight 2(18)

Luo Y, Gao S, Hao Z, Yang Y, Xie S, Li D et al (2016) Apoptosis signal-regulating kinase 1 exhibits oncogenic activity in pancreatic cancer. Oncotarget 7(46):75155–75164

Article  PubMed  PubMed Central  Google Scholar 

Hayakawa Y, Hirata Y, Sakitani K, Nakagawa H, Nakata W, Kinoshita H et al (2012) Apoptosis signal-regulating kinase-1 inhibitor as a potent therapeutic drug for the treatment of gastric cancer. Cancer Sci 103(12):2181–2185

Article  PubMed  PubMed Central  CAS  Google Scholar 

Ogier JM, Nayagam BA, Lockhart PJ (2020) ASK1 inhibition: a therapeutic strategy with multi-system benefits. J Mol Med 98(3):335–348

Article  PubMed  CAS  Google Scholar 

Bahar ME, Kim HJ, Kim DR (2023) Targeting the RAS/RAF/MAPK pathway for cancer therapy: from mechanism to clinical studies. Signal Transduct Target Ther 8(1):455

Article  PubMed  PubMed Central  CAS  Google Scholar 

Blondy S, David V, Verdier M, Mathonnet M, Perraud A, Christou N (2020) 5-Fluorouracil resistance mechanisms in colorectal cancer: from classical pathways to promising processes. Cancer Sci 111(9):3142–3154

Article  PubMed  PubMed Central  CAS  Google Scholar 

Kadoyama KM (2012) Adverse event profiles of 5-fluorouracil and capecitabine: data mining of the public version of the FDA Adverse Event Reporting System, AERS, and reproducibility of clinical observations. Int J Med Sci 9(1):33–39

Article  PubMed  CAS  Google Scholar 

Bolat E, Sarıtaş S, Duman H, Eker F, Akdaşçi E, Karav S et al (2024) Polyphenols: secondary metabolites with a biological impression. Nutrients 16(15):2550

Article  PubMed  PubMed Central  CAS  Google Scholar 

Mondal A, Bhar R, Sinha SN (2021) Ethnomedicinal value and Biological Activities of Spondias mombin L-A Concise Review. Asian Res J Curr Sci 3:87–94

Google Scholar 

Pariyar D, Miya MS, Adhikari A (2021) J Med Herbs 12(2):85–92

Bicas JL, Neri-Numa IA, Ruiz ALTG, De Carvalho JE, Pastore GM (2011) Evaluation of the antioxidant and antiproliferative potential of bioflavors. Food Chem Toxicol 49(7):1610–1615

Article  PubMed  CAS  Google Scholar 

Metibemu DS, Akinloye OA, Akamo AJ, Okoye JO, Ojo DA, Morifi E et al (2020) Carotenoid isolates of Spondias mombin demonstrate anticancer effects in DMBA-induced breast cancer in Wistar rats through X-linked inhibitor of apoptosis protein (XIAP) antagonism and anti-inflammation. J Food Biochem 44(12):1–17

Article  Google Scholar 

Cabral B, Siqueira EMS, Bitencourt MAO, Lima MCJS, Lima AK, Ortmann CF et al (2016) Phytochemical study and anti-inflammatory and antioxidant potential of Spondias mombin leaves. Rev Bras 26(3):304–311

Google Scholar 

Sinan KI, Zengin G, Zheleva-Dimitrova D, Gevrenova R, Picot-Allain MCN, Dall’Acqua S et al (2021) Exploring the chemical profiles and biological values of two spondias species (S. dulcis and S. mombin): valuable sources of bioactive natural products. Antioxidants 10(11):1771

Article  PubMed  PubMed Central  CAS  Google Scholar 

Maestro. Schrödinger Release 2021–2, Maestro. Schrödinge (LLC): New York, NY. 2021

Singh O, Shillings A, Craggs P, Wall I, Rowland P, Skarzynski T et al (2013) Crystal structures of ASK1-inhibtor complexes provide a platform for structure-based drug design. Protein Sci 22(8):1071–1077

Article  PubMed  PubMed Central  CAS  Google Scholar 

Schrödinger LNYNYI. Schrödinger Release 2021–3. Protein Preparation Wizard; Epik, . Schrödinger 2021; Prime, Sch (New York, NY): LLC,. 2021

Iwaloye O, Elekofehinti OO, Momoh AI, Babatomiwa K, Ariyo EO (2020) In silico molecular studies of natural compounds as possible anti-Alzheimer’s agents: ligand-based design. Netw Model Anal Health Inform Bioinform 9(1):1–4

Article  Google Scholar 

Olsson MHM, SØndergaard CR, Rostkowski M, Jensen JH (2011) PROPKA3: consistent treatment of internal and surface residues in empirical p K a predictions. J Chem Theory Comput 7(2):525–537

Comments (0)

No login
gif