Jóhannes Reynisson

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Olga LavrikProfessor, Institute of Chemical Biology and Fundamental Medicine SB RAS, Novosibirsk State UniversityVerified email at niboch.nsc.ru
Euphemia LeungUniversity of AucklandVerified email at auckland.ac.nz
Ayesha ZafarUniversity of AucklandVerified email at aucklanduni.ac.nz
Lisa I. PilkingtonSenior LecturerVerified email at aucklanduni.ac.nz
Christian HartingerProfessor of Chemistry, University of AucklandVerified email at aucklanduni.ac.nz
Suslov EvgeniyФедеральное государственное бюджетное учреждение науки Новосибирский институт органической химии им. Н.Н. Ворожцова Сибирского отделения Российской академии наук (НИОХ СО РАН)Verified email at nioch.nsc.ru
Vedrana Cikes CulicUniversity of Split School of MedicineVerified email at mefst.hr
Naresh SinghalProfessor, Civil & Environmental Engineering, The University of AucklandVerified email at auckland.ac.nz
Anita MarkotićUniversity of Split School of Medicine unist.hrVerified email at mefst.hr
Margaret Anne BrimbleSchool of Biological Sciences, School of Chemical Sciences, the University of Auckland,Verified email at auckland.ac.nz
Paul WorkmanChief Executive & President, Institute of Cancer Research, LondonVerified email at icr.ac.uk
Nikolina Režić MužinićUniversity of Split School of MedicineVerified email at mefst.hr
Viji SarojiniUniversity of AucklandVerified email at auckland.ac.nz
Waseeq SiddiquiUniversity of SargodhaVerified email at uos.edu.pk
Dr. Adnan AshrafUniversity of Lahore, Pakistan/University of Auckland, New ZealandVerified email at aucklanduni.ac.nz
Michael P HayAssociate Professor, University of AucklandVerified email at auckland.ac.nz
Emily Hargrave-ThomasPhD Candidate in Chemical and Materials Engineering, Auckland UniversityVerified email at auckland.ac.nz
Dr. Jagdish K JaiswalSenior Research Fellow, University of AucklandVerified email at auckland.ac.nz
Kurt V. MikkelsenProfessor of Theoretical Chemistry, Department of Chemistry, University of CopenhagenVerified email at chem.ku.dk
yacine hemarThe University of AucklandVerified email at auckland.ac.nz

Jóhannes Reynisson

School of Pharmacy, Keele University, United Kingdom

Verified email at keele.ac.uk - Homepage

Drug discovery molecular modelling Known Drug Space virtual screening


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Benchmarking the reliability of QikProp. Correlation between experimental and predicted values L Ioakimidis, L Thoukydidis, A Mirza, S Naeem, J Reynisson QSAR & Combinatorial Science 27 (4), 445-456, 2008	267	2008
Sorption and biodegradation of organic micropollutants during river bank filtration: A laboratory column study C Bertelkamp, J Reungoat, ER Cornelissen, N Singhal, J Reynisson, ... Water research 52, 231-241, 2014	178	2014
Target profiling of an antimetastatic RAPTA agent by chemical proteomics: relevance to the mode of action MV Babak, SM Meier, KVM Huber, J Reynisson, AA Legin, MA Jakupec, ... Chemical science 6 (4), 2449-2456, 2015	153	2015
Characteristics of known drug space. Natural products, their derivatives and synthetic drugs R Bade, HF Chan, J Reynisson European journal of medicinal chemistry 45 (12), 5646-5652, 2010	144	2010
Hit generation and exploration: imidazo [4, 5-b] pyridine derivatives as inhibitors of Aurora kinases V Bavetsias, C Sun, N Bouloc, JÛ Reynisson, P Workman, ... Bioorganic & medicinal chemistry letters 17 (23), 6567-6571, 2007	122	2007
Synthesis and biological evaluation of novel tyrosyl-DNA phosphodiesterase 1 inhibitors with a benzopentathiepine moiety A Zakharenko, T Khomenko, S Zhukova, O Koval, O Zakharova, ... Bioorganic & Medicinal Chemistry 23 (9), 2044-2052, 2015	109	2015
Intercalation of trioxatriangulenium ion in DNA: binding, electron transfer, X-ray crystallography, and electronic structure J Reynisson, GB Schuster, SB Howerton, LD Williams, RN Barnett, ... Journal of the American Chemical Society 125 (8), 2072-2083, 2003	107	2003
Anticancer Ruthenium(η⁶-p-cymene) Complexes of Nonsteroidal Anti-inflammatory Drug Derivatives F Aman, M Hanif, WA Siddiqui, A Ashraf, LK Filak, J Reynisson, ... Organometallics 33 (19), 5546-5553, 2014	104	2014
Imidazo[4,5-b]pyridine Derivatives As Inhibitors of Aurora Kinases: Lead Optimization Studies toward the Identification of an Orally Bioavailable Preclinical … V Bavetsias, JM Large, C Sun, N Bouloc, M Kosmopoulou, M Matteucci, ... Journal of medicinal chemistry 53 (14), 5213-5228, 2010	103	2010
New water-soluble copper (II) complexes with morpholine–thiosemicarbazone hybrids: Insights into the anticancer and antibacterial mode of action K Ohui, E Afanasenko, F Bacher, RLX Ting, A Zafar, N Blanco-Cabra, ... Journal of medicinal chemistry 62 (2), 512-530, 2018	98	2018
DFT calculations on the electrophilic reaction with water of the guanine and adenine radical cations. A model for the situation in DNA J Reynisson, S Steenken Physical Chemistry Chemical Physics 4 (3), 527-532, 2002	90	2002
Synthesis and cytotoxicity of thieno [2, 3-b] pyridine and furo [2, 3-b] pyridine derivatives JM Hung, HJ Arabshahi, E Leung, J Reynisson, D Barker European journal of medicinal chemistry 86, 420-437, 2014	83	2014
Half‐Sandwich Ruthenium (II) Biotin Conjugates as Biological Vectors to Cancer Cells MV Babak, D Plażuk, SM Meier, HJ Arabshahi, J Reynisson, B Rychlik, ... Chemistry–A European Journal 21 (13), 5110-5117, 2015	74	2015
The effect of PLC-γ2 inhibitors on the growth of human tumour cells L Feng, I Reynisdóttir, J Reynisson European journal of medicinal chemistry 54, 463-469, 2012	70	2012
New inhibitors of tyrosyl-DNA phosphodiesterase I (Tdp 1) combining 7-hydroxycoumarin and monoterpenoid moieties T Khomenko, A Zakharenko, T Odarchenko, HJ Arabshahi, V Sannikova, ... Bioorganic & medicinal chemistry 24 (21), 5573-5581, 2016	69	2016
Investigation of the incidence of “undesirable” molecular moieties for high-throughput screening compound libraries in marketed drug compounds P Axerio-Cilies, IP Castañeda, A Mirza, J Reynisson European journal of medicinal chemistry 44 (3), 1128-1134, 2009	69	2009
Novel tyrosyl-DNA phosphodiesterase 1 inhibitors enhance the therapeutic impact of topoteсan on in vivo tumor models AL Zakharenko, OA Luzina, DN Sokolov, VI Kaledin, VP Nikolin, ... European Journal of Medicinal Chemistry 161, 581-593, 2019	67	2019
From Catalysis to Cancer: Toward Structure–Activity Relationships for Benzimidazol-2-ylidene-Derived N-Heterocyclic-Carbene Complexes as Anticancer Agents NYS Lam, D Truong, H Burmeister, MV Babak, HU Holtkamp, ... Inorganic chemistry 57 (22), 14427-14434, 2018	65	2018
Size estimation of chemical space: how big is it? KLM Drew, H Baiman, P Khwaounjoo, B Yu, J Reynisson Journal of Pharmacy and Pharmacology 64 (4), 490-495, 2012	65	2012
The identification of novel PLC-[gamma] inhibitors using virtual high throughput screening JÛ Reynisson, C O'Neill, J Day, L Patterson, E McDonald, P Workman, ... Bioorganic & medicinal chemistry 17 (8), 3169-3176, 2009	63*	2009

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