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Kinetic and Structural Insights into the Mechanism of Binding of Sulfonamides to Human Carbonic Anhydrase by Computational and Experimental Studies.
J Med Chem. 2016 May 12;59(9):4245-56. doi: 10.1021/acs.jmedchem.5b01643. Epub 2016 Jan 12.
J Med Chem. 2016.
PMID: 26700575
Identification of novel aldose reductase inhibitors based on carboxymethylated mercaptotriazinoindole scaffold.
Stefek M, Soltesova Prnova M, Majekova M, Rechlin C, Heine A, Klebe G.
Stefek M, et al. Among authors: rechlin c.
J Med Chem. 2015 Mar 26;58(6):2649-57. doi: 10.1021/jm5015814. Epub 2015 Mar 4.
J Med Chem. 2015.
PMID: 25695864
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Price for Opening the Transient Specificity Pocket in Human Aldose Reductase upon Ligand Binding: Structural, Thermodynamic, Kinetic, and Computational Analysis.
Rechlin C, Scheer F, Terwesten F, Wulsdorf T, Pol E, Fridh V, Toth P, Diederich WE, Heine A, Klebe G.
Rechlin C, et al.
ACS Chem Biol. 2017 May 19;12(5):1397-1415. doi: 10.1021/acschembio.7b00062. Epub 2017 Apr 5.
ACS Chem Biol. 2017.
PMID: 28287700
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Structural Determinants of the Selectivity of 3-Benzyluracil-1-acetic Acids toward Human Enzymes Aldose Reductase and AKR1B10.
Ruiz FX, Cousido-Siah A, Porté S, Domínguez M, Crespo I, Rechlin C, Mitschler A, de Lera ÁR, Martín MJ, de la Fuente JÁ, Klebe G, Parés X, Farrés J, Podjarny A.
Ruiz FX, et al. Among authors: rechlin c.
ChemMedChem. 2015 Dec;10(12):1989-2003. doi: 10.1002/cmdc.201500393. Epub 2015 Nov 9.
ChemMedChem. 2015.
PMID: 26549844
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