A Comprehensive Investigation of Interactions between Antipsychotic Drug Quetiapine and Human Serum Albumin Using Multi-Spectroscopic, Biochemical, and Molecular Modeling Approaches

被引:51
作者
Zargar, Seema [1 ]
Wani, Tanveer A. [2 ]
Alsaif, Nawaf A. [2 ]
Khayyat, Arwa Ishaq A. [1 ]
机构
[1] King Saud Univ, Coll Sci, Dept Biochem, POB 22452, Riyadh 11451, Saudi Arabia
[2] King Saud Univ, Coll Pharm, Dept Pharmaceut Chem, POB 2457, Riyadh 11451, Saudi Arabia
关键词
quetiapine; human serum albumin; hydrophobic interaction; thermodynamic parameters; KINASE INHIBITOR ERLOTINIB; BINDING; PROTEIN; ACID; DOCKING; MECHANISM; FLUORESCENCE; QUERCETIN;
D O I
10.3390/molecules27082589
中图分类号
Q5 [生物化学]; Q7 [分子生物学];
学科分类号
071010 ; 081704 ;
摘要
Quetiapine (QTP) is a short-acting atypical antipsychotic drug that treats schizophrenia or manic episodes of bipolar disorder. Human serum albumin (HSA) is an essential transport protein that transports hormones and various other ligands to their intended site of action. The interactions of QTP with HSA and their binding mechanism in the HSA-QTP system was studied using spectroscopic and molecular docking techniques. The UV-Vis absorption study shows hyperchromicity in the spectra of HSA on the addition of QTP, suggesting the complex formation and interactions between QTP and HSA. The results of intrinsic fluorescence indicate that QTP quenched the fluorescence of HSA and confirmed the complex formation between HSA and QTP, and this quenching mechanism was a static one. Thermodynamic analysis of the HSA-QTP system confirms the involvement of hydrophobic forces, and this complex formation is spontaneous. The competitive displacement and molecular docking experiments demonstrated that QTP is preferentially bound to HSA subdomain IB. Furthermore, the CD experiment results showed conformational changes in the HSA-QTP system. Besides this, the addition of QTP does not affect the esterase-like activity of HSA. This study will help further understand the credible mechanism of transport and delivery of QTP via HSA and design new QTP-based derivatives with greater efficacy.
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页数:14
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共 51 条
[1]   Understanding the fate of human serum albumin upon interaction with edifenphos: Biophysical and biochemical approaches [J].
Ahmad, Ajaz ;
Ahmad, Masood .
PESTICIDE BIOCHEMISTRY AND PHYSIOLOGY, 2018, 145 :46-55
[2]   Intermediate formation at lower urea concentration in 'B' isomer of human serum albumin: a case study using domain specific ligands [J].
Ahmad, B ;
Khursheed, M ;
Khan, A ;
Haq, SK ;
Khan, RH .
BIOCHEMICAL AND BIOPHYSICAL RESEARCH COMMUNICATIONS, 2004, 314 (01) :166-173
[3]   Drug-drug Interactions of P-gp Substrates Unrelated to CYP Metabolism [J].
Akamine, Yumiko ;
Yasui-Furukori, Norio ;
Uno, Tsukasa .
CURRENT DRUG METABOLISM, 2019, 20 (02) :124-129
[4]   Multi-spectroscopic and molecular modelling approach to investigate the interaction of riboflavin with human serum albumin [J].
Alam, Md. Maroof ;
Qais, Faizan Abul ;
Ahmad, Iqbal ;
Alam, Parvez ;
Khan, Rizwan Hasan ;
Naseem, Imrana .
JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS, 2018, 36 (03) :795-809
[5]   A Spectroscopic, Thermodynamic and Molecular Docking Study of the Binding Mechanism of Dapoxetine with Calf Thymus DNA [J].
Alsaif, Nawaf A. ;
Al-Mehizia, Abdurrahman A. ;
Bakheit, Ahmed H. ;
Zargar, Seema ;
Wani, Tanveer A. .
SOUTH AFRICAN JOURNAL OF CHEMISTRY-SUID-AFRIKAANSE TYDSKRIF VIR CHEMIE, 2020, 73 :44-50
[6]   Sulfenic acid formation in human serum albumin by hydrogen peroxide and peroxynitrite [J].
Carballal, S ;
Radi, R ;
Kirk, MC ;
Barnes, S ;
Freeman, BA ;
Alvarez, B .
BIOCHEMISTRY, 2003, 42 (33) :9906-9914
[7]   Protein stability induced by ligand binding correlates with changes in protein flexibility [J].
Celej, MS ;
Montich, CG ;
Fidelio, GD .
PROTEIN SCIENCE, 2003, 12 (07) :1496-1506
[8]   Mechanism for stabilization of the molten globule state of papain by sodium n-alkyl sulfates:: Spectroscopic and calorimetric approaches [J].
Chamani, J. ;
Heshmati, M. .
JOURNAL OF COLLOID AND INTERFACE SCIENCE, 2008, 322 (01) :119-127
[9]  
de Miranda AS, 2020, NEUROPSYCHOPHARMACOT, P1
[10]   Comparison of Quetiapine Abuse and Misuse Reports to the FDA Adverse Event Reporting System With Other Second-Generation Antipsychotics [J].
Evoy, Kirk E. ;
Teng, Chengwen ;
Encarnacion, Victor G. ;
Frescas, Brian ;
Hakim, John ;
Saklad, Stephen ;
Frei, Christopher R. .
SUBSTANCE ABUSE-RESEARCH AND TREATMENT, 2019, 13