Publications

ZORA Publication List

Publications

• 2022

  • Journal Article

    • Martín, Jaime; Gómez‐Bengoa, Enrique; Genoux, Alexandre; Nevado, Cristina (2022). Synthesis of Cyclometalated Gold(III) Complexes via Catalytic Rhodium to Gold(III) Transmetalation. Angewandte Chemie Internationale Edition, 61(20):e202116755.

• 2021

  • Journal Article

    • Liu, Le; Nevado, Cristina (2021). Diaryl Ether Formation Merging Photoredox and Nickel Catalysis. Organometallics, 40(14):2188-2193.
    • Hervieu, Cédric; Kirillova, Mariia S; Suárez, Tatiana; Müller, Marco; Merino, Estíbaliz; Nevado, Cristina (2021). Asymmetric, visible light-mediated radical sulfinyl-Smiles rearrangement to access all-carbon quaternary stereocentres. Nature Chemistry, 13(4):327-334.
    • Genoux, Alexandre; Biedrzycki, Michał; Merino, Estíbaliz; Rivera‐Chao, Eva; Linden, Anthony; Nevado, Cristina (2021). Synthesis and Characterization of Bidentate (P^N)Gold(III) Fluoride Complexes: Reactivity Platforms for Reductive Elimination Studies. Angewandte Chemie Internationale Edition, 60(8):4164-4168.
    • Cuesta‐Galisteo, Sergio; Schörgenhumer, Johannes; Wei, Xiaofeng; Merino, Estíbaliz; Nevado, Cristina (2021). Nickel‐Catalyzed Asymmetric Synthesis of α‐Arylbenzamides. Angewandte Chemie Internationale Edition, 60(3):1605-1609.
    • Beucher, Hélène; Schörgenhumer, Johannes; Merino, Estíbaliz; Nevado, Cristina (2021). Chelation-assisted C–C bond activation of biphenylene by gold(i) halides. Chemical Science, 12(45):15084-15089.

• 2020

  • Journal Article

    • Beucher, Hélène; Kumar, Sudhir; Kumar, Roopender; Merino, Estíbaliz; Hu, Wei‐Hsu; Stemmler, Gerrit; Cuesta‐Galisteo, Sergio; González, Jorge A; Bezinge, Léonard; Jagielski, Jakub; Shih, Chih-Jen; Nevado, Cristina (2020). Phosphorescent κ 3 -(N^C^C)-Gold(III) Complexes: Synthesis, Photophysics, Computational Studies and Application to Solution-Processable OLEDs. Chemistry - A European Journal, 26(72):17604-17612.
    • González, Jorge A; Verdugo, Felipe; Mascareñas, José Luis; López, Fernando; Nevado, Cristina (2020). [C^N]‐Alkenyl Gold(III) Complexes by Proximal Ring‐Opening of (2‐Pyridyl)alkylidenecyclopropanes: Mechanistic Insights. Angewandte Chemie Internationale Edition, 59(45):20049-20054.
    • Genoux, Alexandre; González, Jorge A; Merino, Estíbaliz; Nevado, Cristina (2020). Mechanistic Insights into C(sp2)−C(sp)N Reductive Elimination from Gold(III) Cyanide Complexes. Angewandte Chemie Internationale Edition, 59(41):17881-17886.
    • Dolbois, Aymeric; Batiste, Laurent; Wiedmer, Lars; Dong, Jing; Brütsch, Manuela; Huang, Danzhi; Deerain, Nicholas M; Spiliotopoulos, Dimitrios; Cheng-Sánchez, Iván; Laul, Eleen; Nevado, Cristina; Śledź, Paweł; Caflisch, Amedeo (2020). Hitting a Moving Target: Simulation and Crystallography Study of ATAD2 Bromodomain Blockers. ACS Medicinal Chemistry Letters, 11(8):1573-1580.
    • Wei, Xiaofeng; Shu, Wei; García-Domínguez, Andrés; Merino, Estíbaliz; Nevado, Cristina (2020). Asymmetric Ni-Catalyzed Radical Relayed Reductive Coupling. Journal of the American Chemical Society, 142(31):13515-13522.
    • Beucher, Hélène; Kumar, Sudhir; Merino, Estíbaliz; Hu, Wei-Hsu; Stemmler, Gerrit; Cuesta-Galisteo, Sergio; González, Jorge A; Jagielski, Jakub; Shih, Chih-Jen; Nevado, Cristina (2020). Highly Efficient Green Solution Processable Organic Light-Emitting Diodes Based on a Phosphorescent κ3-(N^C^C)Gold(III)-Alkynyl Complex. Chemistry of Materials, 32(4):1605-1611.
    • Unzue, Andrea; Jessen-Trefzer, Claudia; Spiliotopoulos, Dimitrios; Gaudio, Eugenio; Tarantelli, Chiara; Dong, Jing; Zhao, Hongtao; Pachmayr, Johanna; Zahler, Stefan; Bernasconi, Elena; Sartori, Giulio; Cascione, Luciano; Bertoni, Francesco; Śledź, Paweł; Caflisch, Amedeo; Nevado, Cristina (2020). Understanding the mechanism of action of pyrrolo[3,2-b]quinoxaline-derivatives as kinase inhibitors. RSC Medicinal Chemistry, 11(6):665-675.

• 2019

  • Journal Article

    • Shu, Wei; García-Domínguez, Andrés; Quirós, M Teresa; Mondal, Rahul; Cárdenas, Diego J; Nevado, Cristina (2019). Ni-Catalyzed Reductive Dicarbofunctionalization of Nonactivated Alkenes: Scope and Mechanistic Insights. Journal of the American Chemical Society, 141(35):13812-13821.
    • García‐Domínguez, Andrés; Mondal, Rahul; Nevado, Cristina (2019). Dual Photoredox/Nickel‐Catalyzed Three‐Component Carbofunctionalization of Alkenes. Angewandte Chemie Internationale Edition, 58(35):12286-12290.
    • Beucher, Hélène; Merino, Estíbaliz; Genoux, Alexandre; Fox, Thomas; Nevado, Cristina (2019). κ3‐(N^C^C)Gold(III) Carboxylates: Evidence for Decarbonylation Processes. Angewandte Chemie Internationale Edition, 58(27):9064-9067.
    • Hofer, Manuel; de Haro, Teresa; Gómez-Bengoa, Enrique; Genoux, Alexandre; Nevado, Cristina (2019). Oxidant speciation and anionic ligand effects in the gold-catalyzed oxidative coupling of arenes and alkynes. Chemical Science, 10(36):8411-8420.

• 2018

  • Journal Article

    • Zhu, Jian; Dong, Jing; Batiste, Laurent; Unzue, Andrea; Dolbois, Aymeric; Pascanu, Vlad; Śledź, Paweł; Nevado, Cristina; Caflisch, Amedeo (2018). Binding Motifs in the CBP Bromodomain: An Analysis of 20 Crystal Structures of Complexes with Small Molecules. ACS Medicinal Chemistry Letters, 9(9):929-934.
    • Dalle Vedove, Andrea; Spiliotopoulos, Dimitrios; D'Agostino, Vito G; Marchand, Jean-Rémy; Unzue, Andrea; Nevado, Cristina; Lolli, Graziano; Caflisch, Amedeo (2018). Structural Analysis of Small-Molecule Binding to the BAZ2A and BAZ2B Bromodomains. ChemMedChem, 13(14):1479-1487.
    • Shu, Wei; Merino, Estíbaliz; Nevado, Cristina (2018). Visible Light Mediated, Redox Neutral Remote 1,6-Difunctionalizations of Alkenes. ACS Catalysis, 8(7):6401-6406.
    • García-Domínguez, Andrés; Nevado, Cristina (2018). Transforming Olefins into Dinucleophiles. CHIMIA International Journal for Chemistry, 72(4):212-215.
    • Unzue, A; Cribiú, R; Hoffman, M M; Knehans, T; Lafleur, K; Caflisch, A; Nevado, C (2018). Iriomoteolides: novel chemical tools to study actin dynamics. Chemical Science, 9(15):3793-3802.
    • Feige, Pascal; de Haro, Teresa; Rusconi, Giulia; Merino, Estibaliz; Nevado, Cristina (2018). Gold-catalyzed oxidative aminoesterification of unactivated alkenes. Monatshefte für Chemie / Chemical Monthly, 149(4):749-754.
    • Batiste, Laurent; Unzue, Andrea; Dolbois, Aymeric; Hassler, Fabrice; Wang, Xuan; Deerain, Nicholas; Zhu, Jian; Spiliotopoulos, Dimitrios; Nevado, Cristina; Caflisch, Amedeo (2018). Chemical Space Expansion of Bromodomain Ligands Guided by in Silico Virtual Couplings (AutoCouple). ACS Central Science, 4(2):180-188.

• 2017

  • Journal Article

    • Kumar, Roopender; Nevado, Cristina (2017). Cyclometalated gold(III) complexes: synthesis, reactivity, and physicochemical properties. Angewandte Chemie Internationale Edition, 56(8):1994-2015.
    • Shu, Wei; Lorente, Adriana; Gómez-Bengoa, Enrique; Nevado, Cristina (2017). Expeditious diastereoselective synthesis of elaborated ketones via remote Csp3–H functionalization. Nature Communications, 8:13832.
    • Shu, Wei; Nevado, Cristina (2017). Visible-light-mediated remote aliphatic C−H functionalizations through a 1,5-hydrogen transfer cascade. Angewandte Chemie Internationale Edition, 56(7):1881-1884.
    • Li, Zhaodong; Merino, Estíbaliz; Nevado, Cristina (2017). Stereoselective carboperfluoroalkylation of internal alkynes: mechanistic insights. Topics in Catalysis, 60(8):545-553.
    • García-Domínguez, Andrés; Li, Zhaodong; Nevado, Cristina (2017). Nickel-catalyzed reductive dicarbofunctionalization of alkenes. Journal of the American Chemical Society, 139(20):6835-6838.
    • García-Domínguez, Andrés; Müller, Simona; Nevado, Cristina (2017). Nickel-catalyzed intermolecular carbosulfonylation of alkynes via sulfonyl radicals. Angewandte Chemie Internationale Edition, 56(33):9949-9952.
    • Shu, Wei; Genoux, Alexandre; Li, Zhaodong; Nevado, Cristina (2017). γ-functionalizations of amines through visible-light-mediated, redox-neutral C−C bond cleavage. Angewandte Chemie Internationale Edition, 56(35):10521-10524.
    • Kumar, Roopender; Krieger, Jean-Philippe; Gómez-Bengoa, Enrique; Fox, Thomas; Linden, Anthony; Nevado, Cristina (2017). The first gold(III) formate: evidence for β-hydride elimination. Angewandte Chemie Internationale Edition, 56(42):12862-12865.
    • Garayalde, David; Rusconi, Giulia; Nevado, Cristina (2017). A gold- and brønsted acid catalytic interplay towards the synthesis of highly substituted tetrahydrocarbazoles. Helvetica Chimica Acta, 100(3):e1600333.

• 2016

  • Journal Article

    • Hofer, Manuel; Genoux, Alexandre; Kumar, Roopender; Nevado, Cristina (2016). Gold-catalyzed direct oxidative arylation with boron coupling partners. Angewandte Chemie Internationale Edition, 56(4):1021-1025.
    • Kumar, Roopender; Linden, Anthony; Nevado, Cristina (2016). Evidence for direct transmetalation of AuIII–F with boronic acids. Journal of the American Chemical Society, 138(42):13790-13793.
    • Felker, Anastasia; Nieuwenhuize, Susan; Dolbois, Aymeric; Blazkova, Kristyna; Hess, Christopher; Low, Larry W L; Burger, Sibylle; Samson, Natasha; Carney, Tom J; Bartunek, Petr; Nevado, Cristina; Mosimann, Christian (2016). In vivo performance and properties of tamoxifen metabolites for CreERT2 control. PLoS ONE, 11(4):e0152989.
    • Unzue, Andrea; Zhao, Hongtao; Lolli, Graziano; Dong, Jing; Zhu, Jian; Zechner, Melanie; Dolbois, Aymeric; Caflisch, Amedeo; Nevado, Cristina (2016). The “Gatekeeper” residue influences the mode of binding of acetyl indoles to bromodomains. Journal of Medicinal Chemistry, 59(7):3087-3097.
    • García-Domínguez, Patricia; Fehr, Lorenz; Rusconi, Giulia; Nevado, Cristina (2016). Palladium-catalyzed incorporation of atmospheric CO2: efficient synthesis of functionalized oxazolidinones. Chemical Science, 7(6):3914-3918.
    • García-Domínguez, Patricia; Nevado, Cristina (2016). Au–Pd bimetallic catalysis: the importance of anionic ligands in catalyst speciation. Journal of the American Chemical Society, 138(10):3266-3269.
    • Unzue, Andrea; Lafleur, Karine; Zhao, Hongtao; Zhou, Ting; Dong, Jing; Kolb, Peter; Liebl, Johanna; Zahler, Stefan; Caflisch, Amedeo; Nevado, Cristina (2016). Three stories on Eph kinase inhibitors: From in silico discovery to in vivo validation. European journal of medicinal chemistry, 112:347-366.
    • Unzue, Andrea; Xu, Ming; Dong, Jing; Wiedmer, Lars; Spiliotopoulos, Dimitrios; Caflisch, Amedeo; Nevado, Cristina (2016). Fragment-based design of selective nanomolar ligands of the crebbp bromodomain. Journal of Medicinal Chemistry, 59(4):1350-1356.

• 2015

  • Journal Article

    • Xu, Min; Unzue, Andrea; Dong, Jing; Spiliotopoulos, Dimitrios; Nevado, Cristina; Caflisch, Amedeo (2015). Discovery of CREBBP bromodomain inhibitors by high-throughput docking and hit optimization guided by molecular dynamics. Journal of Medicinal Chemistry:2487-2491.
    • Kumar, Roopender; Linden, Anthony; Nevado, Cristina (2015). Luminescent (N^C^C)-Gold(III) Complexes: Stabilized Gold(III) fluorides. Angewandte Chemie Internationale Edition, 54(48):14287-14290.
    • Li, Zhaodong; García-Domínguez, Andres; Nevado, Cristina (2015). Pd-catalyzed stereoselective carboperfluoroalkylation of alkynes. Journal of the American Chemical Society, 137(36):11610-11613.
    • Kong, Wangqing; Fuentes, Noelia; García-Domínguez, Andres; Merino, Estíbaliz; Nevado, Cristina (2015). Stereoselective synthesis of highly functionalized indanes and dibenzocycloheptadienes through complex radical cascade reactions. Angewandte Chemie Internationale Edition, 54(8):2487-2491.
    • Fuentes, Noelia; Kong, Wangqing; Fernández-Sánchez, Luis; Merino, Estibaliz; Nevado, Cristina (2015). Cyclization cascades via N-amidyl radicals toward highly functionalized heterocyclic scaffolds. Journal of the American Chemical Society, 137(2):964-973.

• 2014

  • Journal Article

    • Unzue, Andrea; Dong, Jing; Lafleur, Karine; Zhao, Hongtao; Frugier, Emilie; Caflisch, Amedeo; Nevado, Cristina (2014). Pyrrolo[3,2-b]quinoxaline derivatives as types I1/2 and II Eph tyrosine kinase inhibitors: structure-based design, synthesis, and in vivo validation. Journal of Medicinal Chemistry, 57(15):6834-6844.

• 2013

  • Journal Article

    • Lafleur, Karine; Dong, Jing; Huang, Danzhi; Caflisch, Amedeo; Nevado, Cristina (2013). Optimization of inhibitors of the tyrosine kinase EphB4. 2. Cellular potency improvement and binding mode validation by X-ray crystallography. Journal of Medicinal Chemistry, 56(1):84-96.

• 2012

  • Journal Article

    • Linden, Anthony; de Haro, T; Nevado, C (2012). [1,3-Bis(2,6-diisopropylphenyl)imidazol-2-ylidene]chloridogold(I). Acta Crystallographica. Section C, Crystal Structure Communications, 68(1):m1-m3.

• 2010

  • Journal Article

    • Huang, D; Zhou, T; Lafleur, K; Nevado, C; Caflisch, A (2010). Kinase selectivity potential for inhibitors targeting the ATP binding site: A network analysis. Bioinformatics, 26(2):198-204.

Pagination