Search results

  1. 1.
    0586496 - ÚOCHB 2025 RIV eng J - Journal Article
    Nigam, A. - Hurley, M. F. D. - Li, F. - Konkoľová, Eva - Klíma, Martin - Trylčová, Jana - Pollice, R. - Cinaroglu, S. S. - Levin-Konigsberg, R. - Handjaya, J. - Schapira, M. - Chau, I. - Perveen, S. - Ng, H.-L. - Kaniskan, H. U. - Han, Y. - Singh, S. - Gorgulla, C. - Kundaje, A. - Jin, J. - Voelz, V. A. - Weber, Jan - Nencka, Radim - Bouřa, Evžen - Vedadi, M. - Aspuru-Guzik, A.
    Application of established computational techniques to identify potential SARS-CoV-2 Nsp14-MTase inhibitors in low data regimes.
    Digital Discovery. (2024). E-ISSN 2635-098X
    R&D Projects: GA MŠMT(CZ) LX22NPO5103
    Institutional support: RVO:61388963
    Keywords : docking * accuracy
    Method of publishing: Open access
    https://doi.org/10.1039/D4DD00006D
    Permanent Link: https://hdl.handle.net/11104/0353965
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    10.1039d4dd00006d.pdf11.7 MBPublisher’s postprintopen-access
     
     
  2. 2.
    0586203 - ÚOCHB 2025 RIV DE eng J - Journal Article
    Tóth, Luca Julianna - Krejčová, Kateřina - Dejmek, Milan - Žilecká, Eva - Klepetářová, Blanka - Poštová Slavětínská, Lenka - Bouřa, Evžen - Nencka, Radim
    Novel analogues of a nonnucleoside SARS-CoV-2 RdRp inhibitor as potential antivirotics.
    Beilstein Journal of Organic Chemistry. Roč. 20, May (2024), s. 1029-1036. ISSN 1860-5397. E-ISSN 1860-5397
    R&D Projects: GA MŠMT(CZ) LX22NPO5103
    Institutional support: RVO:61388963
    Keywords : antivirotics * nonnucleotide inhibitor * RNA-dependent RNA polymerase * SARS-CoV-2
    Impact factor: 2.7, year: 2022
    Method of publishing: Open access
    https://doi.org/10.3762/bjoc.20.91
    Permanent Link: https://hdl.handle.net/11104/0353790
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    10.3762bjoc.20.91.pdf1914.3 KBPublisher’s postprintopen-access
     
     
  3. 3.
    0583190 - ÚOCHB 2025 RIV US eng J - Journal Article
    Klíma, Martin - Dejmek, Milan - Duchoslav, Vojtěch - Eisenreichová, Andrea - Šála, Michal - Chalupský, Karel - Chalupská, Dominika - Novotná, Barbora - Birkuš, Gabriel - Nencka, Radim - Bouřa, Evžen
    Fluorinated cGAMP analogs, which act as STING agonists and are not cleavable by poxins: Structural basis of their function.
    Structure. Roč. 32, č. 4 (2024), s. 433-439. ISSN 0969-2126. E-ISSN 1878-4186
    R&D Projects: GA MŠMT(CZ) LX22NPO5103
    Institutional support: RVO:61388963
    Keywords : cyclic GMP-AMP * binding * design
    Impact factor: 5.7, year: 2022
    Method of publishing: Open access
    https://doi.org/10.1016/j.str.2024.01.008
    Permanent Link: https://hdl.handle.net/11104/0351191
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    10.1016j.str.2024.01.008.pdf03.1 MBPublisher’s postprintopen-access
     
     
  4. 4.
    0580756 - ÚOCHB 2025 RIV US eng J - Journal Article
    Cermakova, K. - Tao, L. - Dejmek, Milan - Šála, Michal - Montierth, M. D. - Chan, Y. S. - Patel, I. - Chambers, C. - Loeza Cabrera, M. - Hoffman, D. - Parchem, R. J. - Wang, W. - Nencka, Radim - Barbieri, E. - Hodges, H. C.
    Reactivation of the G1 enhancer landscape underlies core circuitry addiction to SWI/SNF.
    Nucleic Acids Research. Roč. 52, č. 1 (2024), s. 4-21. ISSN 0305-1048. E-ISSN 1362-4962
    Institutional support: RVO:61388963
    Keywords : neuroblastoma * differentiation * transcription
    OECD category: Organic chemistry
    Impact factor: 14.9, year: 2022
    Method of publishing: Open access
    https://doi.org/10.1093/nar/gkad1081
    Permanent Link: https://hdl.handle.net/11104/0349518
     

    Research data: ZENODO, NCBI GEO
     
  5. 5.
    0579447 - ÚOCHB 2025 RIV GB eng J - Journal Article
    Misehe, Mbilo - Šála, Michal - Matoušová, Marika - Hercík, Kamil - Kocek, Hugo - Chalupská, Dominika - Chaloupecká, Ema - Hájek, Miroslav - Bouřa, Evžen - Mertlíková-Kaiserová, Helena - Nencka, Radim
    Design, synthesis and evaluation of novel thieno[2,3d]pyrimidine derivatives as potent and specific RIPK2 inhibitors.
    Bioorganic and Medicinal Chemistry Letters. Roč. 97, January (2024), č. článku 129567. ISSN 0960-894X. E-ISSN 1464-3405
    R&D Projects: GA MZd(CZ) NU20-05-00472; GA MŠMT(CZ) LX22NPO5103
    Grant - others:AV ČR(CZ) StrategieAV21/25
    Program: StrategieAV
    Institutional support: RVO:61388963
    Keywords : kinase inhibitor * thieno [2,3d] pyrimidine derivative * receptor-interacting protein kinase 2 * RIPK2 * NOD
    OECD category: Medicinal chemistry
    Impact factor: 2.7, year: 2022
    Method of publishing: Open access
    https://doi.org/10.1016/j.bmcl.2023.129567
    Permanent Link: https://hdl.handle.net/11104/0348249
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    10.1016j.bmcl.2023.129567.pdf11.6 MBPublisher’s postprintopen-access
     
     
  6. 6.
    0576137 - ÚOCHB 2024 RIV US eng J - Journal Article
    Inniss, N. L. - Kozic, Ján - Li, F. - Rosas-Lemus, M. - Minasov, G. - Rybáček, Jiří - Zhu, Y. - Pohl, Radek - Shuvalova, L. - Rulíšek, Lubomír - Brunzelle, J. S. - Bednárová, Lucie - Štefek, Milan - Kormaník, Ján Michael - Andris, Erik - Šebestík, Jaroslav - Li, A. S. M. - Brown, P. J. - Schmitz, U. - Saikatendu, K. - Chang, E. - Nencka, Radim - Vedadi, M. - Satchell, K. J. F.
    Discovery of a Druggable, Cryptic Pocket in SARS-CoV-2 nsp16 Using Allosteric Inhibitors.
    ACS Infectious Diseases. Roč. 9, č. 10 (2023), s. 1918-1931. ISSN 2373-8227
    R&D Projects: GA MŠMT(CZ) EF16_019/0000729; GA MZd(CZ) NU20-05-00472
    Institutional support: RVO:61388963
    Keywords : coronavirus * NSP16 methyltransferase * covalent inhibitors * structural biology * antiviral
    OECD category: Virology
    Impact factor: 5.3, year: 2022
    Method of publishing: Limited access
    https://doi.org/10.1021/acsinfecdis.3c00203
    Permanent Link: https://hdl.handle.net/11104/0345731
     

    Research data: PDB, PDB
     
  7. 7.
    0576080 - ÚOCHB 2024 RIV NL eng J - Journal Article
    Zgarbová, Michala - Otava, Tomáš - Šilhán, Jan - Nencka, Radim - Weber, Jan - Bouřa, Evžen
    Inhibitors of mpox VP39 2′-O methyltransferase efficiently inhibit the monkeypox virus.
    Antiviral Research. Roč. 218, October (2023), č. článku 105714. ISSN 0166-3542. E-ISSN 1872-9096
    R&D Projects: GA MŠMT(CZ) LX22NPO5103
    Institutional support: RVO:61388963
    Keywords : structural basis
    OECD category: Virology
    Impact factor: 7.6, year: 2022
    Method of publishing: Open access
    https://doi.org/10.1016/j.antiviral.2023.105714
    Permanent Link: https://hdl.handle.net/11104/0345703
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    10.1016j.antiviral.2023.105714.pdf01.7 MBPublisher’s postprintopen-access
     
     
  8. 8.
    0574898 - ÚOCHB 2024 RIV NL eng J - Journal Article
    Misehe, Mbilo - Matoušová, Marika - Dvořáková, Alexandra - Hercík, Kamil - Škach, Kryštof - Chalupská, Dominika - Dejmek, Milan - Šála, Michal - Hájek, Miroslav - Bouřa, Evžen - Mertlíková-Kaiserová, Helena - Nencka, Radim
    Exploring positions 6 and 7 of a quinazoline-based scaffold leads to changes in selectivity and potency towards RIPK2/3 kinases.
    European Journal of Medicinal Chemistry. Roč. 260, November (2023), č. článku 115717. ISSN 0223-5234. E-ISSN 1768-3254
    R&D Projects: GA MŠMT(CZ) LX22NPO5103; GA MZd(CZ) NU20-05-00472
    Institutional support: RVO:61388963
    Keywords : kinase inhibitor * quinazoline derivatives * RIPK2 * NOD * inflammation * RIPK3
    OECD category: Medicinal chemistry
    Impact factor: 6.7, year: 2022
    Method of publishing: Open access
    https://doi.org/10.1016/j.ejmech.2023.115717
    Permanent Link: https://hdl.handle.net/11104/0344824
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    10.1016j.ejmech.2023.115717.pdf04.4 MBPublisher’s postprintopen-access
     
     
  9. 9.
    0574383 - ÚOCHB 2024 RIV NL eng J - Journal Article
    Dejmek, Milan - Brázdová, Andrea - Otava, Tomáš - Pimková Polidarová, Markéta - Klíma, Martin - Smola, Miroslav - Vavřina, Zdeněk - Buděšínský, Miloš - Dračínský, Martin - Liboska, Radek - Bouřa, Evžen - Birkuš, Gabriel - Nencka, Radim
    Vinylphosphonate-based cyclic dinucleotides enhance STING-mediated cancer immunotherapy.
    European Journal of Medicinal Chemistry. Roč. 259, November (2023), č. článku 115685. ISSN 0223-5234. E-ISSN 1768-3254
    R&D Projects: GA MŠMT(CZ) LX22NPO5103; GA MZd(CZ) NU20-05-00472
    Research Infrastructure: CCP II - 90126
    Institutional support: RVO:61388963
    Keywords : cyclic dinucleotides * STING * cancer * intratumoral administration * immunotherapy
    OECD category: Medicinal chemistry
    Impact factor: 6.7, year: 2022
    Method of publishing: Open access
    https://doi.org/10.1016/j.ejmech.2023.115685
    Permanent Link: https://hdl.handle.net/11104/0344716
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    10.1016j.ejmech.2023.115685.pdf05.2 MBPublisher’s postprintopen-access
     

    Research data: PDB
     
  10. 10.
    0574366 - ÚOCHB 2024 RIV US eng J - Journal Article
    Břehová, Petra - Řezníčková, E. - Škach, Kryštof - Jorda, R. - Dejmek, Milan - Vojáčková, V. - Šála, Michal - Kovalová, M. - Dračínský, Martin - Dolníková, A. - Strmeň, Timotej - Kinnertová, M. - Chalupský, Karel - Dvořáková, Alexandra - Gucký, T. - Mertlíková-Kaiserová, Helena - Klener, P. - Nencka, Radim - Kryštof, V.
    Inhibition of FLT3-ITD Kinase in Acute Myeloid Leukemia by New Imidazo[1,2-b]pyridazine Derivatives Identified by Scaffold Hopping.
    Journal of Medicinal Chemistry. Roč. 66, č. 16 (2023), s. 11133-11157. ISSN 0022-2623. E-ISSN 1520-4804
    R&D Projects: GA MZd(CZ) NU20-05-00472; GA MŠMT LX22NPO5102
    Institutional support: RVO:61388963
    Keywords : gene expression * highly potent
    OECD category: Oncology
    Impact factor: 7.3, year: 2022
    Method of publishing: Open access
    https://doi.org/10.1021/acs.jmedchem.3c00575
    Permanent Link: https://hdl.handle.net/11104/0344703
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    10.1021acs.jmedchem.3c00575.pdf17.8 MBPublisher’s postprintopen-access
     
     

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