Enzyme inhibition data of structurally novel isatin-containing sulfonamides were determined for two carbonic anhydrases (CAs, EC 4.2.1.1) from pathogenic Candida species (CaNce103 from C. albicans and CgNce103 from C. glabrata). The compounds show K-I values in the low nanomolar range for the fungal CAs, while they have significantly higher K-I values for the human CAs. Homology models were constructed for the CaNce103 and CgNce103 and subsequently the ligands were docked into these models to rationalize their enzyme inhibitory properties. (C) 2016 Elsevier Ltd. All rights reserved.
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Kafrelsheikh Univ, Fac Pharm, Dept Pharmaceut Chem, PO Box 33516, Kafrelsheikh, EgyptKafrelsheikh Univ, Fac Pharm, Dept Pharmaceut Chem, PO Box 33516, Kafrelsheikh, Egypt
Eldehna, Wagdy M.
El-Hamaky, Anwar A.
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Tanta Univ, Fac Pharm, Dept Pharmaceut Chem, Tanta 31527, EgyptKafrelsheikh Univ, Fac Pharm, Dept Pharmaceut Chem, PO Box 33516, Kafrelsheikh, Egypt
El-Hamaky, Anwar A.
Giovannuzzi, Simone
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Univ Florence, Dept NEUROFARBA, Sect Pharmaceut & Nutraceut Sci, Polo Sci, Via U Schiff 6, I-50019 Sesto Fiorentino, Firenze, ItalyKafrelsheikh Univ, Fac Pharm, Dept Pharmaceut Chem, PO Box 33516, Kafrelsheikh, Egypt
Giovannuzzi, Simone
Elsayed, Zainab M.
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Kafrelsheikh Univ, Fac Pharm, Sci Res & Innovat Support Unit, Kafrelsheikh, EgyptKafrelsheikh Univ, Fac Pharm, Dept Pharmaceut Chem, PO Box 33516, Kafrelsheikh, Egypt
Elsayed, Zainab M.
Alkabbani, Mahmoud Abdelrahman
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Egyptian Russian Univ, Fac Pharm, Pharmacol & Toxicol Dept, Cairo 11829, EgyptKafrelsheikh Univ, Fac Pharm, Dept Pharmaceut Chem, PO Box 33516, Kafrelsheikh, Egypt
Alkabbani, Mahmoud Abdelrahman
Khaleel, Eman F.
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King Khalid Univ, Coll Med, Dept Med Physiol, Asir 61421, Saudi ArabiaKafrelsheikh Univ, Fac Pharm, Dept Pharmaceut Chem, PO Box 33516, Kafrelsheikh, Egypt
Khaleel, Eman F.
Al-Sanea, Mohammad M.
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Jouf Univ, Coll Pharm, Dept Pharmaceut Chem, Aljouf 72388, Saudi ArabiaKafrelsheikh Univ, Fac Pharm, Dept Pharmaceut Chem, PO Box 33516, Kafrelsheikh, Egypt
Al-Sanea, Mohammad M.
Abo-Ashour, Mahmoud F.
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El Saleheya El Gadida Univ, Fac Pharm, Dept Pharmaceut Chem, El Saleheya El Gadida, EgyptKafrelsheikh Univ, Fac Pharm, Dept Pharmaceut Chem, PO Box 33516, Kafrelsheikh, Egypt
Abo-Ashour, Mahmoud F.
Elnaggar, Yosra S. R.
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Alexandria Univ, Fac Pharm, Dept Pharmaceut, Alexandria, Egypt
Pharos Univ Alexandria, Res & Int Publishing Adm RIPA, Alexandria, EgyptKafrelsheikh Univ, Fac Pharm, Dept Pharmaceut Chem, PO Box 33516, Kafrelsheikh, Egypt
Elnaggar, Yosra S. R.
Nocentini, Alessio
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Univ Florence, Dept NEUROFARBA, Sect Pharmaceut & Nutraceut Sci, Polo Sci, Via U Schiff 6, I-50019 Sesto Fiorentino, Firenze, ItalyKafrelsheikh Univ, Fac Pharm, Dept Pharmaceut Chem, PO Box 33516, Kafrelsheikh, Egypt
Nocentini, Alessio
Supuran, Claudiu T.
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Univ Florence, Dept NEUROFARBA, Sect Pharmaceut & Nutraceut Sci, Polo Sci, Via U Schiff 6, I-50019 Sesto Fiorentino, Firenze, ItalyKafrelsheikh Univ, Fac Pharm, Dept Pharmaceut Chem, PO Box 33516, Kafrelsheikh, Egypt
Supuran, Claudiu T.
Tawfik, Haytham O.
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Tanta Univ, Fac Pharm, Dept Pharmaceut Chem, Tanta 31527, EgyptKafrelsheikh Univ, Fac Pharm, Dept Pharmaceut Chem, PO Box 33516, Kafrelsheikh, Egypt