Letters in Drug Design & Discovery

Editor-in-Chief

K. Kuca
University of Hradec Kralove
Hradec Kralove
(Czech Republic)

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Articles Ahead of Print

High Anti-cancer Activity, Low Animal Toxicity, and Structure Activity Relationships of Curcumin Analogs

Volume:17
Sen-Chuan Song, Yu-Liang Mai, Hua-Hong Shi, Bing Liao and Fei Wang*

Synthesis and In silico Studies of Quinazolinone Derivatives as PARP-1 Inhibitors

Volume:17
Sonia Verma, Akashdeep Singh Pathania, Somesh Baranwal and Pradeep Kumar*

Novel Coronavirus 2019 Outbreak: A Global Epidemic

Volume:17
Sweta Kamboj*, Rohit Kamboj, Shikha Kamboj, Kumar Guarve and Rohit Dutt

Synthesis And Biological Activity Evaluation Of Polyfunctionalized Anthraquinonehydrazones

Volume:17
Andrii Lozynskyi, Serhii Holota, Ihor Yushyn, Oksana Sabadakh, Olexandr Karpenko, Volodymyr Novikov and Roman Lesyk*

4-Aminosalicylic Acid-Based Hybrid Compounds: Synthesis and In Vitro Antiplasmodial Evaluation

Volume:17
Siphesihle Jama, Xhamla Nqoro, Eric Morifi and Blessing Atim Aderibigbe*

In Silico Anticancer Evaluation, Molecular Docking and Pharmacophore Modeling of Flavonoids against Various Cancer Targets

Volume:17
Jainey P. James, Pankaj Kumar*, Abhishek Kumar, K. Ishwar Bhat and C.S. Sasthry

Drug re-purposing from SARS-CoV led the identification of potential candidate drug target and alternate drug molecules against SARS-CoV-2

Volume:17
PV Parvati Sai Arun*, Razak Hussain, Yusuf Akhter, Mandava Venkata Basaveswara Rao, Perugu Shyam and Sailu Yellaboina

3,4,5-Trisubstituted-1,2,4-triazole Derivatives as Antiproliferative Agents: Synthesis, in vitro Evaluation and Molecular Modelling

Volume:17
Leyla Yurttaş*, Asaf Evrim Evren, Aslıhan Kubilay, Halide Edip Temel and Gülşen Akalın Çiftçi

The Potency of Catechin from Gambir (Uncaria gambir Roxb.) as a Natural Inhibitor of MurA (1UAE) Enzyme: In vitro and In silico studies

Volume:17
Bella Riyana, Desi Harneti Putri Huspa, Mieke Hemiawati Satari and Dikdik Kurnia*

Unveiling the anti-tubercular properties of Biscoumarins, through Biological Evaluation and Docking Studies

Volume:17
Poornima Acharya, M. M. V. Ramana*, Manish Upadhyay and Ganesh Pavale

Evaluating Phenyl Propanoids Isolated from Citrus medica as Potential Inhibitors for Mitotic kinesin Eg5

Volume:17
Himesh Makala*, Venkatasubramanian Ulaganathan, Aravind Sivasubramanian, Narendran Rajendran and Shankar Subramanian

Design, Synthesis, Docking and Computational Pharmacokinetic Profiling of New Pyrazolinyl Thiazolinone Biheterocycles as Potent Antimicrobial Agents

Volume:17
Vinutha Vittala Salian, Badiadka Narayana*, Balladka Kunhanna Sarojini, Sharath Chandra Kodandoor and Anupam Glorious Lobo

Design, Synthesis, In vitro and In silico Evaluation of New Hydrazonebased Antitumor Agents as Potent Akt Inhibitors

Volume:17
Emine Merve Güngör, Mehlika Dilek Altıntop*, Belgin Sever and Gülşen Akalın Çiftçi

Synthesis and Evaluation of Dapagliflozin Ester Prodrugs with Improved Hygroscopicity and Thermal Stability

Volume:17
Si Young Sung, Yu Na Chae, Dae Young Lee, Kyeong Min Kim, Eun Jung Kim, Ji Hye Han, Wook Kim and Sung-Hwa Yoon*

Evaluation of Kaempferol as AKT Dependent mTOR Regulator via Targeting FKBP-12 in Hepatocellular Carcinoma: an In silico Approach

Volume:17
Pooja Siniprasad, Bhagyalakshmi Nair, Vaisali Balasubramaniam, Prashanth Sadanandan, Puliyapally Krishnan Krishnan Namboori and Lekshmi Reghu Nath*

Anti-inflammatory Augmentation Therapy in Obsessive-compulsive Disorder: A Review

Volume:17
Hanie Ghasemi, Homa Nomani, Amirhossein Sahebkar* and Amir Hooshang Mohammadpour

Comparative Proteome Analysis of Mycobacterium tuberculosis Strains - H37Ra, H37Rv, CCDC5180, and CAS/NITR204: A Step Forward to Identify Novel Drug Targets

Volume:17
Shradheya R.R. Gupta, Ekta Gupta, Avnam Ohri, Sandeep Kumar Shrivastava, Sunita Kachhwaha, Vinay Sharma, Rupesh Kumar Mishra and Ravi Ranjan Kumar Niraj*

Novel 2-(5-Aryl)thiophen-2-yl)benzimidazoles; Design, Synthesis and In vitro Evaluation Against Cercarial Phase of Schistosoma mansoni

Volume:17
Serry A. El Bialy, Basem Mansour*, Waleed A. Bayoumi, Amira Taman and Hassan M. Eissaa

Molecular Insights into the Interaction of Ursolic Acid and Cucurbitacin from Colocynth with Therapeutic Targets of Mycobacterium tuberculosis

Volume:17
Muhammad Ajmal Ali, Mohammad Abul Farah*, Joongku Lee, Khalid M. Al-Anazi and Fahad Al-Hemaid

Effect of Cabergoline on Cognitive Impairments in Transgenic Drosophila Model of Parkinson’s Disease

Volume:17
Yasir Hasan Siddique*, Rahul, Mantasha Idrisi and M. Shahid

Novel Benzimidazole Derivatives: Cytotoxic and Apoptotic Properties on Lung Cancer Cell Line

Volume:17
Leyla Yurttas*, Gulsen Akalin Ciftci, Mehmet Onur Aksoy and Seref Demirayak

In Silico Design of a Novel Multi-Epitope Peptide Vaccine Against Hepatocellular Carcinoma

Volume:17
Fatemeh Motamedi Dehbarez, Navid Nezafat and Shirin Mahmoodi*

Discovery of New N-hydrazinecarbothioamide Indazole Hybrids: As Potential Radical (ABTS and DPPH) Scavengers

Volume:17
Rafaila Rafique, Arshia, Kanwal, Khalid Mohammed Khan*, Sridevi Chigurupati, Uzma Salar, Muhammad Taha and Shahnaz Perveen

Natural Sesquiterpene Lactones in the Prevention and Treatment of Inflammatory Disorders and cancer: A Systematic Study of this Emerging Therapeutic Approach based on Chemical and Pharmacological Aspect

Volume:17
Sudip Kumar Mandal, Utsab Debnath, Amresh Kumar, Sabu Thomas, Subhash Chandra Mandal, Manabendra Dutta Choudhury and Partha Palit*

Development of Phthalimide-Donepezil Hybrids as Potent Multitarget- Directed Ligands for the Treatment of Alzheimer’s Disease

Volume:17
Lintao Yu, Jian Shi, Xinfeng Cheng, Keren Wang, Shuang Liu, Wenmin Liu and Zhipei Sang*

Synthesis and Biological Evaluation of Benzodioxol Derivatives as Cyclooxygenase Inhibitors

Volume:17
Nidal Jaradat*, Mohammed Hawash and Murad N. Abualhasan

Oleanolic Acid Derived from Plants: Synthesis and Pharmacological Properties of A-ring Modified Derivatives

Volume:17
Tingjuan Wu, Xu Yao, Guan Wang, Xiaohe Liu, Hongfei Chen, Zehua Yang and Xing Zheng*

Molecular Docking of 4-ehoxychalcones on Oxidoreductase/Pirin Inhibitors and Cytotoxic Evaluation on Breast/Skin Cancer Cell Lines

Volume:17
Kishori Ramachandra Harshitha, Balladka Kunhanna Sarojini*, Badiadka Narayana, Anupam Glorious Lobo and Bhuvanesh Sukhlal Kalal

In Vitro Characteristics of Glioma Cells Targeting by OX26-modified Liposomal Cisplatin

Volume:17
Maryam Sadat Ashrafzadeh, Amir Heydarinasab*, Azim Akbarzadeh and Mehdi Ardjmand

Fingerprint-based 2D-QSAR Models for Predicting Bcl-2 Inhibitors Affinity

Volume:17
Said Byadi, Mouhi Eddine Hachim, Karima Sadik, Črtomir Podlipnik and Aziz Aboulmouhajir*

Indole Curcumin Reverses Multidrug Resistance by Reducing the Expression of ABCB1 and COX2 in Induced Multidrug Resistant Human Lung Cancer Cells

Volume:17
Sankar Pajaniradje , Kumaravel Mohankumar, Rakesh Radhakrishnan , Shamim Akhtar Sufi, Srividya Subramanian , Parthiban Anaikutti, Surya Prakash Rao H and Rukkumani Rajagopalan *

Experimental Study of Therapeutic Efficacy of the Topical Preparation «Kourochitin» in Skin Allergy

Volume:17
Anna Klimovich*, Olga Styshova, Alexander Popov, Tatiana Moskvina , Valentin Stonik, Alexander Tsybulsky and Dmitry Derunov

Binding Mode Prediction and Identification of New Lead Compounds from Natural Products as 3-OST Enzyme Inhibitors

Volume:17
Rui Sousa, NS Hari Narayana Moorthy*, Natercia Bras, Pedro Fernandes and Maria Ramos

A Review on Robust Computational Approaches Based Identification and Authentication of Herbal Raw Drugs

Volume:17
Preet Amol Singh, Neha Bajwa, Subh Naman and Ashish Baldi*

Effect of Steroidal Hormone Pregnenolone on Proliferation and Differentiation of MC3T3-E1 Osteoblast like Cells

Volume:17
Serene A. Badran, Atia-tul-Wahab, Sharmeen Fayyaz, Bushra Taj Muhammad and M. Iqbal Choudhary*

Synthesis, Molecular Docking and α-Glucosidase Inhibitory Activity Study of 2,4,6-triaryl pyrimidine Derivatives

Volume:17
Mohammed Hussen Bule , Roghaieh Esfandyari, Tadesse Bekele Tafesse, Mohsen Amini*, Mohammad Ali Faramarzi and Mohammad Abdollahi