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Items: 1 to 20 of 98

1.

Effect of donor atom identity on metal-binding pharmacophore coordination.

Dick BL, Patel A, McCammon JA, Cohen SM.

J Biol Inorg Chem. 2017 Jun;22(4):605-613. doi: 10.1007/s00775-017-1454-3. Epub 2017 Apr 7.

2.

Exploring the influence of the protein environment on metal-binding pharmacophores.

Martin DP, Blachly PG, McCammon JA, Cohen SM.

J Med Chem. 2014 Aug 28;57(16):7126-35. doi: 10.1021/jm500984b. Epub 2014 Aug 19.

3.

Synthesis, X-ray structure, in silico calculation, and carbonic anhydrase inhibitory properties of benzylimidazole metal complexes.

Bouchouit M, Bouacida S, Zouchoune B, Merazig H, Bua S, Bouaziz Z, Le Borgne M, Supuran CT, Bouraiou A.

J Enzyme Inhib Med Chem. 2018 Dec;33(1):1150-1159. doi: 10.1080/14756366.2018.1481404.

4.

Isosteres of hydroxypyridinethione as drug-like pharmacophores for metalloenzyme inhibition.

Adamek RN, Credille CV, Dick BL, Cohen SM.

J Biol Inorg Chem. 2018 Oct;23(7):1129-1138. doi: 10.1007/s00775-018-1593-1. Epub 2018 Jul 12.

5.

'Unconventional' coordination chemistry by metal chelating fragments in a metalloprotein active site.

Martin DP, Blachly PG, Marts AR, Woodruff TM, de Oliveira CA, McCammon JA, Tierney DL, Cohen SM.

J Am Chem Soc. 2014 Apr 9;136(14):5400-6. doi: 10.1021/ja500616m. Epub 2014 Mar 27.

6.

Design, synthesis, and docking studies of new 1,3,4-thiadiazole-2-thione derivatives with carbonic anhydrase inhibitory activity.

Abdel-Hamid MK, Abdel-Hafez AA, El-Koussi NA, Mahfouz NM, Innocenti A, Supuran CT.

Bioorg Med Chem. 2007 Nov 15;15(22):6975-84. Epub 2007 Aug 22.

PMID:
17822907
7.

Carbonic anhydrase inhibitors. X-ray crystal studies of the carbonic anhydrase II-trithiocarbonate adduct--an inhibitor mimicking the sulfonamide and urea binding to the enzyme.

Temperini C, Scozzafava A, Supuran CT.

Bioorg Med Chem Lett. 2010 Jan 15;20(2):474-8. doi: 10.1016/j.bmcl.2009.11.124. Epub 2009 Nov 27.

PMID:
20005709
8.

Metalloprotein-inhibitor binding: human carbonic anhydrase II as a model for probing metal-ligand interactions in a metalloprotein active site.

Martin DP, Hann ZS, Cohen SM.

Inorg Chem. 2013 Nov 4;52(21):12207-15. doi: 10.1021/ic400295f. Epub 2013 May 24.

9.

Synthesis, characterization and antiglaucoma activity of a novel proton transfer compound and a mixed-ligand Zn(II) complex.

Yenikaya C, Sari M, Bülbül M, Ilkimen H, Celik H, Büyükgüngör O.

Bioorg Med Chem. 2010 Jan 15;18(2):930-8. doi: 10.1016/j.bmc.2009.11.031. Epub 2009 Nov 20.

PMID:
20006931
10.

Synthesis, structure and spectroscopy of new thiopyrone and hydroxypyridinethione transition-metal complexes.

Lewis JA, Tran BL, Puerta DT, Rumberger EM, Hendrickson DN, Cohen SM.

Dalton Trans. 2005 Aug 7;(15):2588-96. Epub 2005 Jun 23.

PMID:
16025179
11.

Oxidation of cyanobenzocycloheptatrienes: Synthesis, photooxygenation reaction and carbonic anhydrase isoenzymes inhibition properties of some new benzotropone derivatives.

Güney M, Coşkun A, Topal F, Daştan A, Gülçin I, Supuran CT.

Bioorg Med Chem. 2014 Jul 1;22(13):3537-43. doi: 10.1016/j.bmc.2014.04.007. Epub 2014 May 2.

PMID:
24856184
12.
13.

QM/MM calculations reveal the different nature of the interaction of two carborane-based sulfamide inhibitors of human carbonic anhydrase II.

Pecina A, Lepšík M, Řezáč J, Brynda J, Mader P, Řezáčová P, Hobza P, Fanfrlík J.

J Phys Chem B. 2013 Dec 19;117(50):16096-104. doi: 10.1021/jp410216m. Epub 2013 Dec 11.

PMID:
24289143
14.

5-Substituted-(1,2,3-triazol-4-yl)thiophene-2-sulfonamides strongly inhibit human carbonic anhydrases I, II, IX and XII: solution and X-ray crystallographic studies.

Leitans J, Sprudza A, Tanc M, Vozny I, Zalubovskis R, Tars K, Supuran CT.

Bioorg Med Chem. 2013 Sep 1;21(17):5130-8. doi: 10.1016/j.bmc.2013.06.041. Epub 2013 Jun 27.

PMID:
23859774
15.

Binding affinity of substituted ureido-benzenesulfonamide ligands to the carbonic anhydrase receptor: a theoretical study of enzyme inhibition.

Sahu C, Sen K, Pakhira S, Mondal B, Das AK.

J Comput Chem. 2013 Aug 15;34(22):1907-16. doi: 10.1002/jcc.23335. Epub 2013 May 24.

PMID:
23712937
16.
17.

Identification of 3,4-Dihydroisoquinoline-2(1H)-sulfonamides as potent carbonic anhydrase inhibitors: synthesis, biological evaluation, and enzyme--ligand X-ray studies.

Gitto R, Agnello S, Ferro S, De Luca L, Vullo D, Brynda J, Mader P, Supuran CT, Chimirri A.

J Med Chem. 2010 Mar 25;53(6):2401-8. doi: 10.1021/jm9014026.

PMID:
20170095
18.

Synthesis, characterization, antimicrobial activity and carbonic anhydrase enzyme inhibitor effects of salicilaldehyde-N-methyl p-toluenesulfonylhydrazone and its Palladium(II), Cobalt(II) complexes.

Alyar S, Adem Ş.

Spectrochim Acta A Mol Biomol Spectrosc. 2014 Oct 15;131:294-302. doi: 10.1016/j.saa.2014.04.121. Epub 2014 Apr 29.

PMID:
24835932
19.

Design, synthesis and biological evaluation of novel pyridine-thiazolidinone derivatives as anticancer agents: Targeting human carbonic anhydrase IX.

Ansari MF, Idrees D, Hassan MI, Ahmad K, Avecilla F, Azam A.

Eur J Med Chem. 2018 Jan 20;144:544-556. doi: 10.1016/j.ejmech.2017.12.049. Epub 2017 Dec 15.

PMID:
29289880
20.

Protein crystal structures with ferrocene and ruthenocene-based enzyme inhibitors.

Salmon AJ, Williams ML, Hofmann A, Poulsen SA.

Chem Commun (Camb). 2012 Feb 25;48(17):2328-30. doi: 10.1039/c2cc15625c. Epub 2012 Jan 18.

PMID:
22258283

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