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

Chandan Sahu; Kaushik Sen; Srimanta Pakhira; Bhaskar Mondal; Abhijit K. Das

doi:10.1002/jcc.23335

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

Journal of Computational Chemistry ◽

10.1002/jcc.23335 ◽

2013 ◽

Vol 34 (22) ◽

pp. 1907-1916 ◽

Cited By ~ 4

Author(s):

Chandan Sahu ◽

Kaushik Sen ◽

Srimanta Pakhira ◽

Bhaskar Mondal ◽

Abhijit K. Das

Keyword(s):

Carbonic Anhydrase ◽

Binding Affinity ◽

Enzyme Inhibition ◽

Theoretical Study

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Convergent synthesis of carbonic anhydrase inhibiting bi‐heterocyclic benzamides: Structure–activity relationship and mechanistic explorations through enzyme inhibition, kinetics, and computational studies

Journal of Heterocyclic Chemistry ◽

10.1002/jhet.4240 ◽

2021 ◽

Author(s):

Farhan M. Khan ◽

Muhammad A. Abbasi ◽

Aziz‐ur‐Rehman ◽

Sabahat Z. Siddiqui ◽

Abdul R. Sadiq Butt ◽

...

Keyword(s):

Carbonic Anhydrase ◽

Enzyme Inhibition ◽

Structure Activity Relationship ◽

Activity Relationship ◽

Computational Studies ◽

Inhibition Kinetics ◽

Convergent Synthesis ◽

Structure Activity ◽

Enzyme Inhibition Kinetics

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Theoretical study of binding affinity for diamidine with DNA

Structural Chemistry ◽

10.1007/s11224-015-0610-z ◽

2015 ◽

Vol 27 (2) ◽

pp. 681-696 ◽

Cited By ~ 3

Author(s):

Chen Song ◽

Xuening Zhang ◽

Fangfang Li ◽

Yanyan Zhu ◽

Chunmei Liu ◽

...

Keyword(s):

Binding Affinity ◽

Theoretical Study

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Theoretical Study of the Catalyzed Hydration of CO2 by Carbonic Anhydrase: A Brief Overview.

Molecular Aspects of Biotechnology: Computational Models and Theories ◽

10.1007/978-94-011-2538-3_12 ◽

1992 ◽

pp. 263-298 ◽

Cited By ~ 2

Author(s):

Miquel Sola ◽

Agusti Lledos ◽

Miquel Duran ◽

Juan Bertran

Keyword(s):

Carbonic Anhydrase ◽

Theoretical Study

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Synthesis carbonic anhydrase enzyme inhibition and antioxidant activity of novel benzothiazole derivatives incorporating glycine, methionine, alanine, and phenylalanine moieties

Journal of Enzyme Inhibition and Medicinal Chemistry ◽

10.1080/14756366.2018.1553040 ◽

2018 ◽

Vol 34 (1) ◽

pp. 343-349 ◽

Cited By ~ 3

Author(s):

Deniz Üzeroğlu Payaz ◽

F. Zehra Küçükbay ◽

Hasan Küçükbay ◽

Andrea Angeli ◽

Claudiu T. Supuran

Keyword(s):

Antioxidant Activity ◽

Carbonic Anhydrase ◽

Enzyme Inhibition ◽

Benzothiazole Derivatives ◽

Carbonic Anhydrase Enzyme

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Effect of enzyme inhibition on the performance of packed-bed biological reactor - a theoretical study

Chemical Engineering & Technology ◽

10.1002/ceat.270110108 ◽

1988 ◽

Vol 11 (1) ◽

pp. 50-56 ◽

Cited By ~ 3

Author(s):

M. M. Hassan ◽

S. A. Beg

Keyword(s):

Enzyme Inhibition ◽

Theoretical Study ◽

Packed Bed

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Correlation analyses on binding affinity of substituted benzenesulfonamides with carbonic anhydrase using ab initio MO calculations on their complex structures (II)

Bioorganic & Medicinal Chemistry Letters ◽

10.1016/j.bmcl.2010.11.050 ◽

2011 ◽

Vol 21 (1) ◽

pp. 141-144 ◽

Cited By ~ 16

Author(s):

Yohei Munei ◽

Kazunori Shimamoto ◽

Masataka Harada ◽

Tatsusada Yoshida ◽

Hiroshi Chuman

Keyword(s):

Carbonic Anhydrase ◽

Ab Initio ◽

Binding Affinity ◽

Complex Structures ◽

Mo Calculations ◽

Ab Initio Mo Calculations ◽

Correlation Analyses ◽

Ab Initio Mo

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Thermodynamic Stability of Carbonic Anhydrase: Measurements of Binding Affinity and Stoichiometry Using ThermoFluor

Biochemistry ◽

10.1021/bi048135v ◽

2005 ◽

Vol 44 (13) ◽

pp. 5258-5266 ◽

Cited By ~ 331

Author(s):

Daumantas Matulis ◽

James K. Kranz ◽

F. Raymond Salemme ◽

Matthew J. Todd

Keyword(s):

Carbonic Anhydrase ◽

Binding Affinity ◽

Thermodynamic Stability

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Binding of sulfonamide and acetamide to the active-site zinc(2+) in carbonic anhydrase: a theoretical study

Biochemistry ◽

10.1021/bi00451a028 ◽

1989 ◽

Vol 28 (25) ◽

pp. 9724-9733 ◽

Cited By ~ 24

Author(s):

Jiin Yun Liang ◽

William N. Lipscomb

Keyword(s):

Carbonic Anhydrase ◽

Active Site ◽

Theoretical Study

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2-Benzylpiperazine: A new scaffold for potent human carbonic anhydrase inhibitors. Synthesis, enzyme inhibition, enantioselectivity, computational and crystallographic studies and in vivo activity for a new class of intraocular pressure lowering agents

European Journal of Medicinal Chemistry ◽

10.1016/j.ejmech.2018.04.002 ◽

2018 ◽

Vol 151 ◽

pp. 363-375 ◽

Cited By ~ 16

Author(s):

Niccolò Chiaramonte ◽

Silvia Bua ◽

Marta Ferraroni ◽

Alessio Nocentini ◽

Alessandro Bonardi ◽

...

Keyword(s):

Intraocular Pressure ◽

Carbonic Anhydrase ◽

Enzyme Inhibition ◽

Carbonic Anhydrase Inhibitors ◽

New Class ◽

Pressure Lowering ◽

Human Carbonic Anhydrase

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Carbonic anhydrase enzyme inhibition and biological activities of Satureja hortensis L. essential oil

Industrial Crops and Products ◽

10.1016/j.indcrop.2020.112849 ◽

2020 ◽

Vol 156 ◽

pp. 112849

Author(s):

Derya Efe

Keyword(s):

Carbonic Anhydrase ◽

Essential Oil ◽

Enzyme Inhibition ◽

Biological Activities ◽

Satureja Hortensis ◽

Carbonic Anhydrase Enzyme

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