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Selected Publications (1998 - Present)
Calculation of Relative Binding Free Energy Differences for Fructose
1,6-Bisphosphatase Inhibitors Using the Thermodynamic Cycle Perturbation
Approach
M. Rami Reddy and Mark D. Erion
J. Am. Chem. Soc. 2001, 123, 6246-6252
Isolation of a Family of Organic Anion Transporters from Human Liver
and Kidney
William Sun, RongRong Wu, Paul D. van Poelje, and Mark D. Erion
Biochem. Biophys. Res. Comm. 2001, 283, 417-422
AMP Deaminase Inhibitors. 5. Design, Synthesis, and SAR of a Highly
Potent Inhibitor Series
Srinivas Rao Kasibhatla, Brett C. Bookser, Wei Xiao, and Mark D. Erion
J. Med. Chem. 2001, 44, 613-618
Solid Phase Extraction Purification of Carboxylic Acid Products from
96-well Format Solution Phase Synthesis with DOWEX 1x8-400 Formate Anion
Exchange Resin
Brett C. Bookser and Shirong Zhu
J. Comb. Chem. 2001, 3, 205-215
Computer-Assisted Scanning of Ligand Interactions: Analysis of the
Fructose 1,6-Bisphosphatase-AMP Complex Using Free Energy Calculations
Mark D. Erion, Paul D. van Poelje, and M. Rami Reddy
J. Am. Chem. Soc. 2000, 122, 6114-6115
AMP Deaminase Inhibitors. 2. Initial Discovery of a Non-Nucleotide
Transition-State Inhibitor Series
Brett C. Bookser, Srinivas Rao Kasibhatla, James R. Appleman, and Mark
D. Erion
J. Med. Chem. 2000, 43, 1495-1507
AMP Deaminase Inhibitors. 3. SAR of 3-(Carboxyarylalkyl)coformycin
Aglycon
Analogues
Srinivas Rao Kasibhatla, Brett C. Bookser, Gary Probst, James R. Appleman,
and Mark D. Erion
J. Med. Chem. 2000, 43, 1508-1518
AMP Deaminase Inhibitors. 4. Further N3-Substituted Coformycin Aglycon
Analogues: N3-Alkylmalonates as Ribose 5'-Monophosphate Mimetics
Brett C. Bookser, Srinivas Rao Kasibhatla, and Mark D. Erion
J. Med. Chem. 2000, 43, 1519-1524
Free Energy Calculations: Use and Limitations in Predicting Ligand
Binding Affinities
M. Rami Reddy, Mark D. Erion, and Atul Agarwal
Reviews in Computational Chemistry, Vol. 6, K. B. Lipkowitz and D. B.
Boyd, eds., VCH Publishers: New York, 2000, pp. 217-304
Adenosine Kinase Inhibitors. 1. Synthesis, Enzyme Inhibition, and
Antiseizure Activity of 5-Iodotubercidin Analogues
Bheemarao G. Ugarkar, Jay S. DaRe, Joseph J. Kopcho, Clinton E.
Browne, III, Juergen M. Schanzer, James B. Wiesner, and Mark D.
Erion
J. Med. Chem. 2000, 43, 2883-2893
Adenosine Kinase Inhibitors. 2. Synthesis, Enzyme Inhibition, and
Antiseizure Activity of Diaryltubercidin Analogues
Bheemarao G. Ugarkar, Angelo J. Castellino, Jay S. DaRe, Joseph
J. Kopcho, James B. Wiesner, Juergen M. Schanzer, and Mark D. Erion
J. Med. Chem. 2000, 43, 2894-2905
2-Benzyloxymethyl-5-(tributylstannyl)tetrazole. A Reagent for the
Preparation of 5-Aryl- and 5-Heteroaryl-1H-Tetrazoles via the Stille Reaction
Brett C. Bookser
Tetrahedron Lett. 2000, 41, 2805-2809
Efficient Synthesis of Purine Analogues: An FeCl3-SiO2-Promoted Cyclization
Reaction of 4,5-Diaminopyrimidines with Aldehydes Leading to 6,8,9-Trisubstituted
Purines
Qun Dang, Brian S. Brown, and Mark D. Erion
Tetrahedron Lett. 2000, 41, 6559-6562
Discovery of AMP Mimetics that Exhibit High Inhibitory Potency and
Specificity for AMP Deaminase
Mark D. Erion, Srinivas Rao Kasibhatla, Brett C. Bookser, Paul D. van
Poelje,
M. Rami Reddy, Harry E. Gruber, and James R. Appleman
J. Am. Chem. Soc. 1999, 121, 308-319
Synthesis of Phosphonate 3-Phthalidyl Esters as Prodrugs for Potential
Intracellular Delivery of Phosphonates
Qun Dang, Brian S. Brown, Paul D. van Poelje, Timothy J. Colby, and Mark
D. Erion
Bioorg. Med. Chem. Lett. 1999, 9, 1505-1510
Adenosine Kinase Inhibitors as a Novel Approach to Anticonvulsant
Therapy
James B. Wiesner, Bheemarao G. Ugarkar, Angelo J. Castellino, Jerzy Barankiewicz,
David P. Dumas, Harry E. Gruber, Alan C. Foster, and Mark D. Erion
J. Pharm. Exp. Ther. 1999, 289, 1669-1677
Efficient Synthesis of Purines and Purine Nucleosides via an Inverse
Electron Demand Diels-Alder Reaction
Qun Dang, Yan Liu, and Mark D. Erion
J. Am. Chem. Soc. 1999, 121, 5833-5834
Calculation of Relative Solvation Free Energy Differrences by Thermodynamic
Perturbation Method: Dependence of Free Energy Results on Simulation Length
M. Rami Reddy and Mark D. Erion
J. Comp. Chem. 1999, 20, 1018-1027
Structure of Human Adenosine Kinase at 1.5 Å Resolution
Irimpan I. Mathews, Mark D. Erion, and Steven E. Ealick
Biochemistry 1998, 37, 15607-15620
Calculation of Relative Hydration Free Energy Differences for Heteroaromatic
Compounds: Use in the Design of Adenosine Deaminase and Cytidine Deaminase
Inhibitors
Mark D. Erion and M. Rami Reddy
J. Am. Chem. Soc. 1998, 120, 3295-3304
The Therapeutic Potential of Agents Acting via Purine Receptors
James R. Appleman and Mark D. Erion
Exp. Opin. Invest. Drugs 1998, 7, 225-243
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