HIV-1 Entry Inhibitors: A Review of Experimental and Computational Studies

被引：12

作者：

Rad, Tahereh Mostashari ^{[1
]}

Saghaie, Lotfollah ^{[1
]}

Fassihi, Afshin ^{[1
,2
]}

机构：

[1] Isfahan Univ Med Sci, Sch Pharm & Pharmaceut Sci, Dept Med Chem, Esfahan 8174673461, Iran

[2] Isfahan Univ Med Sci, Sch Adv Technol Med, Bioinformat & Syst Biol Dept, Esfahan 8174673461, Iran

来源：

CHEMISTRY & BIODIVERSITY | 2018年 / 15卷 / 10期

关键词：

HIV-1-entry; anti-HIV agents; CCR5; CXCR4; gp41; gp120; SUBSTITUTED PYRROLE DERIVATIVES; SMALL-MOLECULE CD4-MIMICS; CCR5; ANTAGONISTS; BINDING-SITES; CD4; BINDING; RESISTANCE; DESIGN; GP120; POTENT; GP41;

D O I：

10.1002/cbdv.201800159

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：

The HIV-1 life cycle consists of different events, such as cell entry and fusion, virus replication, assembly and release of the newly formed virions. The more logical way to inhibit HIV transmission among individuals is to inhibit its entry into the immune host cells rather than targeting the intracellular viral enzymes. Both viral and host cell surface receptors and co-receptors are regarded as potential targets in anti-HIV-1 drug design process. Because of the importance of this topic it was decided to summarize recent reports on small-molecule HIV-1 entry inhibitors that have not been considered in the latest released reviews. All the computational studies reported in the literature regarding HIV-1 entry inhibitors since 2014 was also considered in this review.

引用

页数：19

共 81 条

[1] Computational discovery of novel HIV-1 entry inhibitors based on potent and broad neutralizing antibody VRC01 [J].

Andrianov, Alexander M. ;

Kashyn, Ivan A. ;

Tuzikov, Alexander V. .

JOURNAL OF MOLECULAR GRAPHICS & MODELLING, 2015, 61 :262-271

[2]

[Anonymous], 2016, Long-acting HIV fusion inhibitor and application thereof, Patent No. [CN105646717A, 105646717]

[3] Structure prediction of GPCRs using piecewise homologs and application to the human CCR5 chemokine receptor: validation through agonist and antagonist docking [J].

Arumugam, Karthik ;

Crouzy, Serge ;

Chevigne, Andy ;

Seguin-Devaux, Carole ;

Schmit, Jean-Claude .

JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS, 2014, 32 (08) :1274-1289

[4] Implementation and Evaluation of a Docking-Rescoring Method Using Molecular Footprint Comparisons [J].

Balius, Trent E. ;

Mukherjee, Sudipto ;

Rizzo, Robert C. .

JOURNAL OF COMPUTATIONAL CHEMISTRY, 2011, 32 (10) :2273-2289

[5] Computational study of bindings of olive leaf extract (OLE) to HIV-1 fusion protein gp41 [J].

Bao, J. ;

Zhang, D. W. ;

Zhang, J. Z. H. ;

Huang, P. Lee ;

Huang, P. Lin ;

Lee-Huang, S. .

FEBS LETTERS, 2007, 581 (14) :2737-2742

[6] COMPUTATIONAL STUDY OF HIV-1 gp41 NHR TRIMER: INHIBITION MECHANISMS OF N-SUBSTITUTED PYRROLE DERIVATIVES AND FRAGMENT-BASED VIRTUAL SCREENING [J].

Bao, Ju ;

Liu, Jin F. ;

He, Xiao ;

Zhang, John Z. H. .

JOURNAL OF THEORETICAL & COMPUTATIONAL CHEMISTRY, 2013, 12 (08)

[7] Tuning Side Arm Electronics in Unsymmetrical Cyclotriazadisulfonamide (CADA) Endoplasmic Reticulum (ER) Translocation Inhibitors to Improve their Human Cluster of Differentiation 4 (CD4) Receptor Down-Modulating Potencies [J].

Chawla, Reena ;

Van Puyenbroeck, Victor ;

Pflug, Nicholas C. ;

Sama, Alekhya ;

Ali, Rameez ;

Schols, Dominique ;

Vermeire, Kurt ;

Bell, Thomas W. .

JOURNAL OF MEDICINAL CHEMISTRY, 2016, 59 (06) :2633-2647

[8]

Clinicaltrialsgov, STUD AMD11070 HIV IN

[9] A Cinnamon-Derived Procyanidin Compound Displays Anti-HIV-1 Activity by Blocking Heparan Sulfate- and Co-Receptor- Binding Sites on gp120 and Reverses T Cell Exhaustion via Impeding Tim-3 and PD-1 Upregulation [J].

Connell, Bridgette Janine ;

Chang, Sui-Yuan ;

Prakash, Ekambaranellore ;

Yousfi, Rahima ;

Mohan, Viswaraman ;

Posch, Wilfried ;

Wilflingseder, Doris ;

Moog, Christiane ;

Kodama, Eiichi N. ;

Clayette, Pascal ;

Lortat-Jacob, Hugues .

PLoS One, 2016, 11 (10)

[10] Pyrazolo-Piperidines Exhibit Dual Inhibition of CCR5/CXCR4 HIV Entry and Reverse Transcriptase [J].

Cox, Bryan D. ;

Prosser, Anthony R. ;

Sun, Yongnian ;

Li, Zhufang ;

Lee, Sangil ;

Huang, Ming B. ;

Bond, Vincent C. ;

Snyder, James P. ;

Krystal, Mark ;

Wilson, Lawrence J. ;

Liotta, Dennis C. .

ACS MEDICINAL CHEMISTRY LETTERS, 2015, 6 (07) :753-757

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