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Shalley N Kudalkar
Shalley N Kudalkar
Associate Principal Scientist- Merck
Verified email at yale.edu
Title
Cited by
Cited by
Year
Potent noncovalent inhibitors of the main protease of SARS-CoV-2 from molecular sculpting of the drug perampanel guided by free energy perturbation calculations
CH Zhang, EA Stone, M Deshmukh, JA Ippolito, MM Ghahremanpour, ...
ACS central science 7 (3), 467-475, 2021
2162021
The Peroxidase and Cyclooxygenase Activity of Prostaglandin H Synthase
SN Kudalkar, CA Rouzer, LJ Marnett
Heme Peroxidases by Emma Raven, Brian Dunford,, 245-271, 2015
63*2015
Covalent inhibitors for eradication of drug-resistant HIV-1 reverse transcriptase: From design to protein crystallography
AH Chan, WG Lee, KA Spasov, JA Cisneros, SN Kudalkar, ZO Petrova, ...
Proceedings of the National Academy of Sciences 114 (36), 9725-9730, 2017
552017
From in silico hit to long-acting late-stage preclinical candidate to combat HIV-1 infection
SN Kudalkar, J Beloor, E Quijano, KA Spasov, WG Lee, JA Cisneros, ...
Proceedings of the National Academy of Sciences 115 (4), E802-E811, 2018
342018
Action at a Distance: Mutations of Peripheral Residues Transform Rapid Reversible Inhibitors to Slow, Tight Binders of Cyclooxygenase-2
AL Blobaum, S Xu, SW Rowlinson, KC Duggan, S Banerjee, SN Kudalkar, ...
The Journal of Biological Chemistry 290, 12793-12803, 2015
332015
13-Methylarachidonic acid is a positive allosteric modulator of endocannabinoid oxygenation by cyclooxygenase
SN Kudalkar, SP Nikas, PJ Kingsley, S Xu, JJ Galligan, CA Rouzer, ...
Journal of Biological Chemistry 290 (12), 7897-7909, 2015
272015
(R)-N-(1-Methyl-2-hydroxyethyl)-13-(S)-methyl-arachidonamide (AMG315): A Novel Chiral Potent Endocannabinoid Ligand with Stability to Metabolizing Enzymes
Journal of Medicinal Chemistry, 2018
222018
Structural and pharmacological evaluation of a novel non-nucleoside reverse transcriptase inhibitor as a promising long acting nanoformulation for treating HIV
SN Kudalkar, I Ullah, N Bertoletti, HK Mandl, JA Cisneros, J Beloor, ...
Antiviral research 167, 110-116, 2019
172019
Structural and preclinical studies of computationally designed non-nucleoside reverse transcriptase inhibitors for treating HIV infection
SN Kudalkar, J Beloor, AH Chan, WG Lee, WL Jorgensen, P Kumar, ...
Molecular pharmacology 91 (4), 383-391, 2017
172017
Enhancing the peroxidatic activity of KatG by deletion mutagenesis
SN Kudalkar, RA Campbell, Y Li, CL Varnado, C Prescott, DC Goodwin
Journal of Inorganic Biochemistry 116, 106-115, 2012
172012
Structure-guided identification of DNMT3b inhibitors
AS Newton, JC Faver, G Micevic, V Muthusamy, SN Kudalkar, N Bertoletti, ...
ACS Medicinal Chemistry Letters 11 (5), 971-976, 2020
152020
Assay of Endocannabinoid Oxidation by Cyclooxygenase-2
SN Kudalkar, P Kingsley, LJ Marnett
Endocannabinoid Signaling- Methods and Protocols 1412, 205-215, 2016
14*2016
A role for catalase-peroxidase large loop 2 revealed by deletion mutagenesis: control of active site water and ferric enzyme reactivity
SN Kudalkar, OJ Njuma, Y Li, M Muldowney, NR Fuanta, DC Goodwin
Biochemistry 54 (8), 1648-1662, 2015
92015
Potent Noncovalent Inhibitors of the Main Protease of SARS-CoV-2 from Molecular Sculpting of the Drug Perampanel Guided by Free Energy Perturbation Calculations. ACS Cent. Sci …
CH Zhang, EA Stone, M Deshmukh, JA Ippolito, MM Ghahremanpour, ...
DOI: https://doi. org/10.1021/acscentsci. 1c00039. PMID: https://www. ncbi …, 0
9
DRONE: Direct tracking of DNA cytidine deamination and other DNA modifying activities
T Sasaki, S Kudalkar, N Bertoletti, K Anderson
Analytical Chemistry, 2018
62018
Long‐acting and extended‐release implant and nanoformulations with a synergistic antiretroviral two‐drug combination controls HIV‐1 infection in a humanized mouse model
J Beloor, SN Kudalkar, G Buzzelli, F Yang, HK Mandl, JK Rajashekar, ...
Bioengineering & Translational Medicine 7 (1), e10237, 2022
52022
Molecular and cellular studies evaluating a potent 2-cyanoindolizine catechol diether NNRTI targeting wildtype and Y181C mutant HIV-1 reverse transcriptase
T Sasaki, ZTK Gannam, SN Kudalkar, KM Frey, WG Lee, KA Spasov, ...
Bioorganic & medicinal chemistry letters 29 (16), 2182-2188, 2019
42019
Potent noncovalent inhibitors of the main protease of SARS-CoV-2 from molecular sculpting of the drug perampanel guided by free energy perturbation calculations, ACS Cent. Sci …
CH Zhang, EA Stone, M Deshmukh, JA Ippolito, MM Ghahremanpour, ...
4
The Structural Basis of Cyclooxygenase‐2 Inhibition by Fenamates
S Xu, S Banerjee, SN Kudalkar, ET Perry, K Ghebreselasie, LJ Marnett
The FASEB Journal 30, 842.6-842.6, 2016
22016
Roles of Large Loops in Catalytic Versatility of Catalase-Peroxidases: Significance of Peripheral Structures in Improvising Enzyme Functions
SN Kudalkar
22012
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Articles 1–20