Search Results - "Ajani, Haresh"

Malonate-based inhibitors of mammalian serine racemase: Kinetic characterization and structure-based computational study by Vorlová, Barbora, Nachtigallová, Dana, Jirásková-Vaníčková, Jana, Ajani, Haresh, Jansa, Petr, Řezáč, Jan, Fanfrlík, Jindřich, Otyepka, Michal, Hobza, Pavel, Konvalinka, Jan, Lepšík, Martin

“…Overactivation of NMDA receptors has been implicated in various neuropathological conditions, including brain ischaemia, neurodegenerative disorders and…”
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Protection of pancreatic islets from oxidative cell death by a peripherally-active morphinan with increased drug safety by Scholz, Okka, Huß, Elena, Otter, Silke, Herebian, Diran, Hamacher, Anna, Levy, Laura Mariana, Hristeva, Stanimira, Sanz, Miguel, Ajani, Haresh, Puentes, Alfredo Rodriguez, Hoffmann, Torsten, Hogeback, Jens, Unger, Anke, Terheyden, Susanne, Reina do Fundo, Michelle, Dewidar, Bedair, Roden, Michael, Lammert, Eckhard

“…Dextromethorphan (DXM) is a commonly used antitussive medication with positive effects in people with type 2 diabetes mellitus, since it increases glucose…”
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Synthesis and structure–activity relationship of potent, selective and orally active anthranilamide-based factor Xa inhibitors: Application of weakly basic sulfoximine group as novel S4 binding element by Pandya, Vrajesh, Jain, Mukul, Chakrabarti, Ganes, Soni, Hitesh, Parmar, Bhavesh, Chaugule, Balaji, Patel, Jigar, Jarag, Tushar, Joshi, Jignesh, Joshi, Nirav, Rath, Akshyaya, Unadkat, Vishal, Sharma, Bhavesh, Ajani, Haresh, Kumar, Jeevan, Sairam, Kalapatapu V.V.M., Patel, Harilal, Patel, Pankaj

“…A novel series of potent and efficacious factor Xa inhibitors which possesses sulfoximine moiety as novel S4 binding element in anthranilamide chemotype has…”
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Superior Performance of the SQM/COSMO Scoring Functions in Native Pose Recognition of Diverse Protein–Ligand Complexes in Cognate Docking by Ajani, Haresh, Pecina, Adam, Eyrilmez, Saltuk M, Fanfrlík, Jindřich, Haldar, Susanta, Řezáč, Jan, Hobza, Pavel, Lepšík, Martin

“…General and reliable description of structures and energetics in protein–ligand (PL) binding using the docking/scoring methodology has until now been elusive…”
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Polysubstituted Pyrimidines as mPGES‐1 Inhibitors: Discovery of Potent Inhibitors of PGE2 Production with Strong Anti‐inflammatory Effects in Carrageenan‐Induced Rat Paw Edema by Kalčic, Filip, Kolman, Viktor, Ajani, Haresh, Zídek, Zdeněk, Janeba, Zlatko

“…We report an extensive structure‐activity relationship optimization of polysubstituted pyrimidines that led to the discovery of…”
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Polysubstituted Pyrimidines as mPGES‐1 Inhibitors: Discovery of Potent Inhibitors of PGE 2 Production with Strong Anti‐inflammatory Effects in Carrageenan‐Induced Rat Paw Edema by Kalčic, Filip, Kolman, Viktor, Ajani, Haresh, Zídek, Zdeněk, Janeba, Zlatko

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Polysubstituted Pyrimidines as mPGES-1 Inhibitors: Discovery of Potent Inhibitors of PGE 2 Production with Strong Anti-inflammatory Effects in Carrageenan-Induced Rat Paw Edema by Kalčic, Filip, Kolman, Viktor, Ajani, Haresh, Zídek, Zdeněk, Janeba, Zlatko

“…We report an extensive structure-activity relationship optimization of polysubstituted pyrimidines that led to the discovery of…”
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Polysubstituted Pyrimidines as mPGES‐1 Inhibitors: Discovery of Potent Inhibitors of PGE2 Production with Strong Anti‐inflammatory Effects in Carrageenan‐Induced Rat Paw Edema by Kalčic, Filip, Kolman, Viktor, Ajani, Haresh, Zídek, Zdeněk, Janeba, Zlatko

“…The Front Cover illustrates the cyclooxygenase (COX) highway (pathway), a part of the arachidonic acid (AA) cascade, where prostaglandins (PGE2, PGI2, PGD2,…”
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Unraveling the Structure–Affinity Relationship between Cucurbit[n]urils (n = 7, 8) and Cationic Diamondoids by Sigwalt, David, Šekutor, Marina, Cao, Liping, Zavalij, Peter Y, Hostaš, Jiří, Ajani, Haresh, Hobza, Pavel, Mlinarić-Majerski, Kata, Glaser, Robert, Isaacs, Lyle

“…We report the measurement of the binding constants (K a) for cucurbit­[n]­uril (n = 7, 8) toward four series of guests based on 2,6-disubstituted adamantanes,…”
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Effect of introducing aib in a designed helical inhibitor of hdm2-p53 interaction: A molecular dynamics study by Chattopadhyay, Sarbani, Ajani, Haresh, Basu, Gautam

“…ABSTRACT Although p53 is an intrinsically disordered protein, upon binding to Hdm2, a short stretch (residues 19‐25) comprising the binding epitope assumes a…”
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3 H -Pyrazolo[4,3- f ]quinoline-Based Kinase Inhibitors Inhibit the Proliferation of Acute Myeloid Leukemia Cells In Vivo by Dayal, Neetu, Řezníčková, Eva, Hernandez, Delmis E., Peřina, Miroslav, Torregrosa-Allen, Sandra, Elzey, Bennett D., Škerlová, Jana, Ajani, Haresh, Djukic, Stefan, Vojáčková, Veronika, Lepšík, Martin, Řezáčová, Pavlína, Kryštof, Vladimír, Jorda, Radek, Sintim, Herman O.

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The synthesis and cholinesterase inhibitory activities of solasodine analogues with seven-membered F ring by Kiełczewska, Urszula, Jorda, Radek, Gonzalez, Gabriel, Morzycki, Jacek W., Ajani, Haresh, Svrčková, Katarína, Štěpánková, Šárka, Wojtkielewicz, Agnieszka

“…[Display omitted] •A series of solasodine analogues with 5/7 spiroether unit were synthesized.•Solasodine, 22a(N)-homo-, and 26a-homosolasodine analogues were…”
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Activity of 2,6,9-trisubstituted purines as potent PDGFRα kinase inhibitors with antileukaemic activity by Řezníčková, Eva, Gucký, Tomáš, Kováčová, Veronika, Ajani, Haresh, Jorda, Radek, Kryštof, Vladimír

“…Receptor tyrosine kinase PDGFRα is often constitutively activated in various tumours and is regarded as a drug target. Here, we present a collection of…”
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Synthesis of 4-styrylpyrazoles and Evaluation of their Inhibitory Effects on Cyclin-dependent Kinases by Toman, Daniel, Jorda, Radek, Ajani, Haresh, Kryštof, Vladimír, Cankař, Petr

“…Cycle-regulating and transcriptional cyclin-dependent kinases (CDKs) are attractive targets in cancer drug development. Several CDK inhibitors have already…”
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Discovery of N 2‑(4-Amino-cyclohexyl)-9-cyclopentyl‑N 6‑(4-morpholin-4-ylmethyl-phenyl)-9H-purine-2,6-diamine as a Potent FLT3 Kinase Inhibitor for Acute Myeloid Leukemia with FLT3 Mutations by Gucký, Tomáš, Řezníčková, Eva, Radošová Muchová, Tereza, Jorda, Radek, Klejová, Zuzana, Malínková, Veronika, Berka, Karel, Bazgier, Václav, Ajani, Haresh, Lepšík, Martin, Divoký, Vladimír, Kryštof, Vladimír

“…FLT3 tyrosine kinase is a potential drug target in acute myeloid leukemia (AML) because patients with FLT3-ITD mutations respond poorly to standard cytotoxic…”
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3H‑Pyrazolo[4,3‑f]quinoline-Based Kinase Inhibitors Inhibit the Proliferation of Acute Myeloid Leukemia Cells In Vivo by Dayal, Neetu, Řezníčková, Eva, Hernandez, Delmis E, Peřina, Miroslav, Torregrosa-Allen, Sandra, Elzey, Bennett D, Škerlová, Jana, Ajani, Haresh, Djukic, Stefan, Vojáčková, Veronika, Lepšík, Martin, Řezáčová, Pavlína, Kryštof, Vladimír, Jorda, Radek, Sintim, Herman O

“…The 3H-pyrazolo­[4,3-f]­quinoline moiety has been recently shown to be a privileged kinase inhibitor core with potent activities against acute myeloid leukemia…”
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A Nexus between Theory and Experiment: Non-Empirical Quantum Mechanical Computational Methodology Applied to Cucurbit[n]urilGuest Binding Interactions by Hostas, Jirí, Sigwalt, David, Sekutor, Marina, Ajani, Haresh, Dubecky, Matús, ezac, Jan, Zavalij, Peter Y, Cao, Liping, Wohlschlager, Christian, Mlinaric-Majerski, Kata, Isaacs, Lyle, Glaser, Robert, Hobza, Pavel

“…A training set of eleven X-ray structures determined for biomimetic complexes between cucurbit[n]uril (CB[7 or 8]) hosts and adamantane-/diamantane…”
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Imidazo[1,2‐c]pyrimidin‐5(6H)‐one as a novel core of cyclin‐dependent kinase 2 inhibitors: Synthesis, activity measurement, docking, and quantum mechanical scoring by Ajani, Haresh, Jansa, Josef, Köprülüoğlu, Cemal, Hobza, Pavel, Kryštof, Vladimír, Lyčka, Antonín, Lepsik, Martin

“…We report on the synthesis, activity testing, docking, and quantum mechanical scoring of novel imidazo[1,2‐c]pyrimidin‐5(6H)‐one scaffold for cyclin‐dependent…”
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Tetrahydropyrazolo[1,5-a]pyridine-fused steroids and their in vitro biological evaluation in prostate cancer by Jorda, Radek, Lopes, Susana M.M., Řezníčková, Eva, Ajani, Haresh, Pereira, António V., Gomes, Clara S.B., M.V.D. Pinho e Melo, Teresa

“…The androgen receptor (AR) is a steroid hormone receptor and its high expression and disruption of its regulation are strongly implicated in prostate cancer…”
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A Nexus between Theory and Experiment: Non-Empirical Quantum Mechanical Computational Methodology Applied to Cucurbit[n]uril⋅Guest Binding Interactions by Hostaš, Jiří, Sigwalt, David, Šekutor, Marina, Ajani, Haresh, Dubecký, Matúš, Řezáč, Jan, Zavalij, Peter Y., Cao, Liping, Wohlschlager, Christian, Mlinarić-Majerski, Kata, Isaacs, Lyle, Glaser, Robert, Hobza, Pavel

“…A training set of eleven X‐ray structures determined for biomimetic complexes between cucurbit[n]uril (CB[7 or 8]) hosts and adamantane‐/diamantane…”
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