{"title":"Synthesis of thiazolidinedione derivatives and their lipoxygenase inhibition","authors":"Melita Lončarić, M. Molnar, I. Strelec, V. Pavić","doi":"10.3390/ecmc2021-11478","DOIUrl":"https://doi.org/10.3390/ecmc2021-11478","url":null,"abstract":"","PeriodicalId":20499,"journal":{"name":"Proceedings of 7th International Electronic Conference on Medicinal Chemistry","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2021-11-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"90549948","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
The knowledge of carbohydrate molecular structure is essential for understanding various processes in glycobiology. Dermatan sulphate (DS) belongs to the group of glycosaminoglycan (GAG) polysaccharides with biological importance [1]. DS is present in various tissues in higher organisms, e.g. in skin, blood vessels or lungs and plays important roles in various processes, namely intercellular and cell-matrix interactions, cell migrations and morphogenesis [2]. The investigation of DS solution properties and formation of their intermolecular complexes with proteins rely mainly on methods of theoretical chemistry as well as high-resolution NMR spectroscopy. In the present contribution, the results of calculations of molecular geometry of dermatan sulphate by density functional theory (DFT) are discussed and compared with experimental spectroscopic data.
{"title":"Molecular structure of dermatan sulphate tetrasaccharide","authors":"M. Hricovíni","doi":"10.3390/ecmc2021-11456","DOIUrl":"https://doi.org/10.3390/ecmc2021-11456","url":null,"abstract":"The knowledge of carbohydrate molecular structure is essential for understanding various processes in glycobiology. Dermatan sulphate (DS) belongs to the group of glycosaminoglycan (GAG) polysaccharides with biological importance [1]. DS is present in various tissues in higher organisms, e.g. in skin, blood vessels or lungs and plays important roles in various processes, namely intercellular and cell-matrix interactions, cell migrations and morphogenesis [2]. The investigation of DS solution properties and formation of their intermolecular complexes with proteins rely mainly on methods of theoretical chemistry as well as high-resolution NMR spectroscopy. In the present contribution, the results of calculations of molecular geometry of dermatan sulphate by density functional theory (DFT) are discussed and compared with experimental spectroscopic data.","PeriodicalId":20499,"journal":{"name":"Proceedings of 7th International Electronic Conference on Medicinal Chemistry","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2021-11-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"91418058","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"Heterologous expression, purification and enzymatic activity of aldo-keto reductase 1C4","authors":"Sofija Bekic, E. Petri, A. Ćelić","doi":"10.3390/ecmc2021-11455","DOIUrl":"https://doi.org/10.3390/ecmc2021-11455","url":null,"abstract":"","PeriodicalId":20499,"journal":{"name":"Proceedings of 7th International Electronic Conference on Medicinal Chemistry","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2021-11-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"91491695","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Liubov V. Krylova, Vasily Otvagin, N. Kuzmina, A. Nyuchev, A. Fedorov, I. Balalaeva
{"title":"Anticancer effect of a chlorin e6 conjugate with vandetanib for combined photodynamic and targeted therapy","authors":"Liubov V. Krylova, Vasily Otvagin, N. Kuzmina, A. Nyuchev, A. Fedorov, I. Balalaeva","doi":"10.3390/ecmc2021-11545","DOIUrl":"https://doi.org/10.3390/ecmc2021-11545","url":null,"abstract":"","PeriodicalId":20499,"journal":{"name":"Proceedings of 7th International Electronic Conference on Medicinal Chemistry","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2021-11-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"75975304","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Jarosław Nuszkiewicz, Marlena Budek, J. Czuczejko, B. Małkowski, K. Szewczyk-Golec
{"title":"Selected parameters of carbohydrate metabolism and adipose tissue activity in patients with lip, oral cavity and pharyngeal cancer","authors":"Jarosław Nuszkiewicz, Marlena Budek, J. Czuczejko, B. Małkowski, K. Szewczyk-Golec","doi":"10.3390/ecmc2021-11527","DOIUrl":"https://doi.org/10.3390/ecmc2021-11527","url":null,"abstract":"","PeriodicalId":20499,"journal":{"name":"Proceedings of 7th International Electronic Conference on Medicinal Chemistry","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2021-11-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"73405099","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
B. Santos, C. Rodrigues, Marques Silva, A. Fontes, D. Macêdo
{"title":"Silver nanoprisms enhances in vitro photodynamic activity of methylene blue against Candida albicans","authors":"B. Santos, C. Rodrigues, Marques Silva, A. Fontes, D. Macêdo","doi":"10.3390/ecmc2021-11571","DOIUrl":"https://doi.org/10.3390/ecmc2021-11571","url":null,"abstract":"","PeriodicalId":20499,"journal":{"name":"Proceedings of 7th International Electronic Conference on Medicinal Chemistry","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2021-11-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"75238744","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"Unveiling the therapeutic potential of verbascoside to combat diabetic wound","authors":"B. Sarkar, Rajdeep Saha","doi":"10.3390/ecmc2021-11476","DOIUrl":"https://doi.org/10.3390/ecmc2021-11476","url":null,"abstract":"","PeriodicalId":20499,"journal":{"name":"Proceedings of 7th International Electronic Conference on Medicinal Chemistry","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2021-11-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"75530529","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"Observation of efflux pump inhibition activity of naringenin, quercetin, and umbelliferone on some multidrug-resistant microorganisms","authors":"E. Altınöz, Ergin Murat Altuner","doi":"10.3390/ecmc2021-11486","DOIUrl":"https://doi.org/10.3390/ecmc2021-11486","url":null,"abstract":"","PeriodicalId":20499,"journal":{"name":"Proceedings of 7th International Electronic Conference on Medicinal Chemistry","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2021-11-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"73301617","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
E. Fokina, A. Bakhtyukov, K. Derkach, V. Sorokoumov, Lev Klys, A. Shpakov
{"title":"The development of ligands of the thyrotropin receptor transmembrane allosteric site with the activity of antagonists and inverse agonists","authors":"E. Fokina, A. Bakhtyukov, K. Derkach, V. Sorokoumov, Lev Klys, A. Shpakov","doi":"10.3390/ecmc2021-11495","DOIUrl":"https://doi.org/10.3390/ecmc2021-11495","url":null,"abstract":"","PeriodicalId":20499,"journal":{"name":"Proceedings of 7th International Electronic Conference on Medicinal Chemistry","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2021-11-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"90108325","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"Rational design of new antipsychotic virtual derivatives with improved ADMET properties and high binding activity","authors":"Alexia-Maria Lapadat, R. Tamaian","doi":"10.3390/ecmc2021-11479","DOIUrl":"https://doi.org/10.3390/ecmc2021-11479","url":null,"abstract":"","PeriodicalId":20499,"journal":{"name":"Proceedings of 7th International Electronic Conference on Medicinal Chemistry","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2021-11-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"83313122","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
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