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Magnetic Resonance in Medicine, ISSN 0740-3194, 07/2013, Volume 70, Issue 1, pp. 33 - 39
High resolution compressed sensing hyperpolarized super(13)C magnetic resonance spectroscopic imaging was applied in orthotopic human glioblastoma xenografts... 
Carbonate dehydratase
Journal Article
Bioorganic and Medicinal Chemistry Letters, ISSN 0960-894X, 04/2010, Volume 20, Issue 8, pp. 2508 - 2511
A series of 2-(hydrazinocarbonyl)-3-substituted-phenyl-1H-indole-5-sulfonam ides and 1-({[5-(aminosulfonyl)-3-phenyl-1H-indol-2-yl]carbonyl}amino)-2 ,4,6... 
Carbonate dehydratase
Journal Article
Bioorganic and Medicinal Chemistry, ISSN 0968-0896, 03/2013, Volume 21, Issue 6, pp. 1427 - 1430
The parameterization of carbonic anhydrase binding site in OPLS-AA force field was performed using quantum chemistry calculations. Both OH2 and OH- forms of... 
Quantum chemistry | Carbonate dehydratase
Journal Article
Drug Discovery Today, ISSN 1359-6446, 06/2018, Volume 23, Issue 6, pp. 1258 - 1266
Ligandability is a prerequisite for druggability and is a much easier concept to understand, model and predict because it does not depend on the complex... 
PROTEIN-LIGAND COMPLEXES | STRUCTURAL BIOLOGY | BINDING-SITE PREDICTION | HOT-SPOTS | PHARMACOLOGY & PHARMACY | WATER-MOLECULES | ACCESSIBLE DATABASE | DRUGGABILITY | IDENTIFICATION | MAXIMAL AFFINITY | CHALLENGES
Journal Article
PLoS ONE, 12/2013, Volume 8, Issue 12
Background Carbonic anhydrase 9 (CA9) is reportedly overexpressed in several types of carcinomas and is generally considered a marker of malignancy. The... 
Carbonate dehydratase
Journal Article
Journal Article
Bioorganic and Medicinal Chemistry Letters, ISSN 0960-894X, 02/2013, Volume 23, Issue 3, pp. 740 - 743
A small series of C-cinnamoyl glycoside containing the phenol moiety was tested for the inhibition of the three Mycobacterium tuberculosis [beta]-carbonic... 
Tuberculosis | Phenols | Carbonate dehydratase | glycosides
Journal Article
Journal Article
Bioorganic and Medicinal Chemistry, ISSN 0968-0896, 03/2013, Volume 21, Issue 6, pp. 1555 - 1563
A series of new, halogen containing N-substituted 4-aminobenzenesulfonamides were synthesized by using superacid HF/SbF5 chemistry and investigated as... 
Cavities | Sulfonamides | Halogens | Metals | Carbonate dehydratase
Journal Article
Bioorganic and Medicinal Chemistry, ISSN 0968-0896, 03/2013, Volume 21, Issue 6, pp. 1410 - 1418
A set of sulfamides and sulfamates were synthesized and tested against several isoforms of carbonic anhydrase: CA I, CA II, CA VII, CA XII and CA XIV. The... 
Aromatics | sulfamide | Molecular modelling | Isoenzymes | Carbonate dehydratase
Journal Article
Bioorganic and Medicinal Chemistry, ISSN 0968-0896, 03/2013, Volume 21, Issue 6, pp. 1386 - 1391
By using phthalimido-substituted aromatic sufonamides as lead molecules, a series of new sulfonamides incorporating ortho-benzenedisulfonimide moieties have... 
Aromatics | Isoenzymes | Sulfonamides | acetazolamide | Amino acids | Carbonate dehydratase | Hydrogen bonding
Journal Article
Bioorganic and Medicinal Chemistry, ISSN 0968-0896, 03/2013, Volume 21, Issue 6, pp. 1489 - 1494
A small series of C-cinnamoyl glycosides incorporating the phenol moiety has been prepared by reaction of glycosyl ketones with the appropriate benzaldehydes.... 
Carbohydrates | pharmacophores | scaffolds | Phenols | Carbonate dehydratase | ketones | glycosides
Journal Article
Bioorganic and Medicinal Chemistry, ISSN 0968-0896, 03/2013, Volume 21, Issue 6, pp. 1511 - 1515
New compounds containing a novel zinc binding group (salicylaldoxime system) were identified as effective inhibitors of carbonic anhydrases (CAs). This... 
Oxygen | Sulfonamides | Computer applications | Carbonate dehydratase | oximes | Zinc
Journal Article
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