Topic 09 -- Abstracts with Biological Entities (English) - 75 Topics / Sub-Topic Model 54 - 15 Topics

cite ad title authors publish year publish time dataset abstract mentions covid pmcid pubmed id doi cord uid topic weight Similarity scispacy Similarity specter
1 Baddeley_2012 1,3-Diphenyl-4,5-dihydro-1H-pyrazol-5-one Baddeley, Thomas C.; Wardell, Solange M. S. V.; Tiekink, Edward R. T.; Wardell, James L. 2012 2012-03-10 COMM-USE N PMC3343981 22589890.0 10.1107/s1600536812009567 dg90gulb 0.951862 David_2013 Gündüz_2012, Pomeisl_2019, Głowacka_2015, Tsoukala_2010
2 Bryndal_2019 Crystal structure, vibrational and optic properties of 2-N-methylamino-3-methylpyridine N-oxide – Its X-ray and spectroscopic studies as well as DFT quantum chemical calculations Bryndal, I.; Lorenc, J.; Macalik, L.; Michalski, J.; Sąsiadek, W.; Lis, T.; Hanuza, J. 2019 2019-11-05 PMC N 10.1016/j.molstruc.2019.05.064 1l4cwxnn 0.862318 Belova_2018, Karpińska_2013
3 Belova_2018 The molecular structure of 4-methylpyridine-N-oxide: Gas-phase electron diffraction and quantum chemical calculations Belova, Natalya V.; Girichev, Georgiy V.; Kotova, Vitaliya E.; Korolkova, Kseniya A.; Trang, Nguyen Hoang 2018 2018-03-15 PMC N PMC7094666 10.1016/j.molstruc.2017.11.070 6vql2u75 0.856202 Karpińska_2013, Bryndal_2019, _2018 Thomson_2010, Pomeisl_2019, Sahoo_2016
4 Gündüz_2012 Ethyl 4-(5-bromo-1H-indol-3-yl)-2,6,6-trimethyl-5-oxo-1,4,5,6,7,8-hexa­hydro­quinoline-3-carboxyl­ate Gündüz, Miyase Gözde; Butcher, Ray J.; Öztürk Yildirim, Sema; El-Khouly, Ahmed; Şafak, Cihat; Şimşek, Rahime 2012 2012-11-24 COMM-USE N PMC3588994 23476230.0 10.1107/s1600536812046909 h45zlv8f 0.841092 David_2013 Pomeisl_2019, Głowacka_2015, Tabuchi_2009, Tsoukala_2010
5 Karpińska_2013 On constitutional isomers and tautomers of oxadiazolones and their mono- and disulfur analogues (C2H2N2XY; X,Y=S,O) Karpińska, Grażyna; Dobrowolski, Jan Cz. 2013 2013-02-01 PMC N PMC7104208 10.1016/j.comptc.2012.11.003 ehqerbt1 0.760390 Pomeisl_2019, Piotrowska_2019, Yoshizawa_2020, Szűcs_2018
6 Abraham_2019 Computational evaluation of the reactivity and pharmaceutical potential of an organic amine: A DFT, molecular dynamics simulations and molecular docking approach Abraham, Christina Susan; Muthu, S.; Prasana, Johanan Christian; Armaković, Stevan; Armaković, Sanja J.; Rizwana B., Fathima; Geoffrey, Ben; David R., Host Antony 2019 2019-11-05 PMC N PMC7108230 31176999.0 10.1016/j.saa.2019.117188 58riya2h 0.753825 Belova_2018, Pahonțu_2015, _2018, Sahoo_2016
7 Havrylyuk_2016 Synthetic approaches, structure activity relationship and biological applications for pharmacologically attractive pyrazole/pyrazoline–thiazolidine-based hybrids Havrylyuk, Dmytro; Roman, Olexandra; Lesyk, Roman 2016 2016-05-04 PMC N PMC7115613 26922234.0 10.1016/j.ejmech.2016.02.030 cok7upy9 0.745013 Kryshchyshyn_2018, Sahoo_2016, Bozorov_2019, Kaminskyy_2017
8 Liu_S_2012 Application of Consensus Scoring and Principal Component Analysis for Virtual Screening against β-Secretase (BACE-1) Liu, Shu; Fu, Rao; Zhou, Li-Hua; Chen, Sheng-Ping 2012 2012-06-11 COMM-USE N PMC3372491 22701601.0 10.1371/journal.pone.0038086 7vwpvcdd 0.673731 Theerawatanasirikul_2020
9 Mlostoń_2010 Synthesis of β-amino-α-trifluoromethyl alcohols and their applications in organic synthesis Mlostoń, Grzegorz; Obijalska, Emilia; Heimgartner, Heinz 2010 2010-08-31 PMC N PMC7125969 10.1016/j.jfluchem.2010.05.014 b3ukefxq 0.654621 MacDonald_2012, Yazarians_2017, Ghosh_2015, Kale_2010 Paramonova_2017, Lin_Z_2012, Kasthuri_2011, Tayade_2015
10 Rachwal_2008 5.01 1,2,3-Triazoles Rachwal, S.; Katritzky, A.R. 2008 2008-12-31 PMC N 10.1016/b978-008044992-0.00501-0 qobzttqa 0.643881 Bozorov_2019, Pomeisl_2019, Głowacka_2015
11 Zhao_2020 Pyrazolone structural motif in medicinal chemistry: Retrospect and prospect Zhao, Zefeng; Dai, Xufen; Li, Chenyang; Wang, Xiao; Tian, Jiale; Feng, Ying; Xie, Jing; Ma, Cong; Nie, Zhuang; Fan, Peinan; Qian, Mingcheng; He, Xirui; Wu, Shaoping; Zhang, Yongmin; Zheng, Xiaohui 2020 2020-01-15 PMC N PMC7115706 31761383.0 10.1016/j.ejmech.2019.111893 qxbdr377 0.605809
12 Kaminskyy_2017 5-Ene-4-thiazolidinones – An efficient tool in medicinal chemistry Kaminskyy, Danylo; Kryshchyshyn, Anna; Lesyk, Roman 2017 2017-11-10 PMC N PMC7111298 28987611.0 10.1016/j.ejmech.2017.09.031 nzykgiyr 0.595431 Carbone_2013, Bozorov_2019, Kryshchyshyn_2018, Sahoo_2016
13 Roman_2015 Mannich bases in medicinal chemistry and drug design Roman, Gheorghe 2015 2015-01-07 PMC N PMC7115492 25462280.0 10.1016/j.ejmech.2014.10.076 f8pyn3rx 0.555195
14 Jalali-Heravi_2009 Shuffling multivariate adaptive regression splines and adaptive neuro-fuzzy inference system as tools for QSAR study of SARS inhibitors Jalali-Heravi, M.; Asadollahi-Baboli, M.; Mani-Varnosfaderani, A. 2009 2009-12-05 PMC N PMC7126869 19665859.0 10.1016/j.jpba.2009.07.009 bf5rct4q 0.545805 Zhou_2010
15 _2018 Spectroscopic (FT-IR, FT-Raman) investigation, topology (ESP, ELF, LOL) analyses, charge transfer excitation and molecular docking (dengue, HCV) studies on ribavirin Rizwana B., Fathima; Muthu, S.; Prasana, Johanan Christian; Abraham, Christina Susan; Raja, M. 2018 2018-12-31 PMC N PMC7148669 10.1016/j.cdc.2018.09.003 5dtksv1n 0.520476 Abraham_2019
16 Kryshchyshyn_2018 Thiopyrano[2,3-d]Thiazoles as New Efficient Scaffolds in Medicinal Chemistry Kryshchyshyn, Anna; Roman, Olexandra; Lozynskyi, Andrii; Lesyk, Roman 2018 2018-06-14 COMM-USE N PMC6027677 29903979.0 10.3390/scipharm86020026 qohx5eyg 0.513064 Bozorov_2019, Sahoo_2016, Carbone_2013
17 Dakkouri_2013 A theoretical investigation of the structure of 2-nitropyridine-N-oxide and the dependency of the NO(2) torsional motion on the applied wavefunction and basis set Dakkouri, Marwan; Typke, Volker 2013 2013-01-23 PMC N PMC7088725 10.1007/s11224-012-0198-5 c59s8kji 0.503100 Karpińska_2013 Belova_2018, Tsoukala_2010
18 Bozorov_2019 1,2,3-Triazole-containing hybrids as leads in medicinal chemistry: A recent overview Bozorov, Khurshed; Zhao, Jiangyu; Aisa, Haji A. 2019 2019-08-15 PMC N 31300317.0 10.1016/j.bmc.2019.07.005 nb73qdix 0.499616 Kuo_R_2009, MacDonald_2012, Mlostoń_2010, Ghosh_2015 Kryshchyshyn_2018, Głowacka_2015, Carbone_2013, Sahoo_2016
19 Olsufyeva_2020 Main trends in the design of semi-synthetic antibiotics of a new generation Olsufyeva, Evgenia N.; Yankovskaya, Valentina S. 2020 2020-03-23 PMC N PMC7149660 10.1070/rcr4892 nypnib0h 0.465443 Zhao_2016
20 Briguglio_2015 Benzotriazole: An overview on its versatile biological behavior Briguglio, I.; Piras, S.; Corona, P.; Gavini, E.; Nieddu, M.; Boatto, G.; Carta, A. 2015 2015-06-05 PMC N PMC7115563 25293580.0 10.1016/j.ejmech.2014.09.089 aa2taq7z 0.438037 Sahoo_2016
21 Khanna_2020 Spiro‐Indole‐Coumarin Hybrids: Synthesis, ADME, DFT, NBO Studies and In Silico Screening through Molecular Docking on DNA G‐Quadruplex Khanna, Leena; Singhal, Sugandha; Jain, Subhash C.; Khanna, Pankaj 2020 2020-03-19 PMC N PMC7169502 10.1002/slct.201904783 5drr3fyt 0.421941
22 Singh_2000 Innate defences against viraemia Singh, Indra P.; Baron, Samuel 2000 2000-11-23 PMC N PMC7159352 11114078.0 10.1002/1099-1654(200011/12)10:6<395::aid-rmv298>3.0.co;2-v na6319rg 0.405753
23 Ghosh_2015 Organic Carbamates in Drug Design and Medicinal Chemistry Ghosh, Arun K.; Brindisi, Margherita 2015 2015-01-07 PMC N PMC4393377 25565044.0 10.1021/jm501371s o8rlqsq5 0.399597 Mlostoń_2010, Bozorov_2019 Bozorov_2019, Ramajayam_2010, Kryshchyshyn_2018
24 More_2019 Metal complexes driven from Schiff bases and semicarbazones for biomedical and allied applications: a review More, M.S.; Joshi, P.G.; Mishra, Y.K.; Khanna, P.K. 2019 2019-12-31 PMC N PMC7110249 10.1016/j.mtchem.2019.100195 p3ocduvi 0.365949 Abu-Dief_2015, MacDonald_2012, Bozorov_2019 Abu-Dief_2015, Sahoo_2016, Bozorov_2019, Kryshchyshyn_2018
25 Balzarini_2005 Pyridine N-oxide derivatives are inhibitory to the human SARS and feline infectious peritonitis coronavirus in cell culture Balzarini, Jan; Keyaerts, Els; Vijgen, Leen; Vandermeer, Frank; Stevens, Miguel; De Clercq, Erik; Egberink, Herman; Van Ranst, Marc 2005 2005-12-29 PMC N PMC7110042 16387746.0 10.1093/jac/dki481 1ln02cyq 0.364190
26 Abu-Dief_2015 A review on versatile applications of transition metal complexes incorporating Schiff bases Abu-Dief, Ahmed M.; Mohamed, Ibrahim M.A. 2015 2015-06-30 PMC N PMC7104041 10.1016/j.bjbas.2015.05.004 65r3pkqi 0.347728 Roman_2015 More_2019, Sahoo_2016, Roman_2015
27 Zhao_2019 Research progress in the biological activities of 3,4,5-trimethoxycinnamic acid (TMCA) derivatives Zhao, Zefeng; Song, Huanhuan; Xie, Jing; Liu, Tian; Zhao, Xue; Chen, Xufei; He, Xirui; Wu, Shaoping; Zhang, Yongmin; Zheng, Xiaohui 2019 2019-07-01 PMC N PMC7115657 31009908.0 10.1016/j.ejmech.2019.04.009 01mvhsrk 0.309036 Bozorov_2019, Sahoo_2016