Exploring Novel N-Myristoyltransferase Inhibitors: A Molecular Dynamics Simulation Approach

por Khalil, Ruqaiya, Ashraf, Sajda, Khalid, Asaad, Ul-Haq, Zaheer
Publicado 2019

Quantum mechanics and 3D-QSAR studies on thienopyridine analogues: inhibitors of IKKβ

por Ul-Haq, Zaheer, Khan, Alamgir, Ashraf, Sajda, Morales-Bayuelo, Alejandro
Publicado 2020

3D-QSAR Studies on Barbituric Acid Derivatives as Urease Inhibitors and the Effect of Charges on the Quality of a Model

por Ul-Haq, Zaheer, Ashraf, Sajda, Al-Majid, Abdullah Mohammed, Barakat, Assem
Publicado 2016

Exploration of the structural requirements of Aurora Kinase B inhibitors by a combined QSAR, modelling and molecular simulation approach

por Ashraf, Sajda, Ranaghan, Kara E., Woods, Christopher J., Mulholland, Adrian J., Ul-Haq, Zaheer
Publicado 2021

The 4-(dimethylaminoalkyl)piperazine inhibitors of α-glucosidase: allosteric enzyme inhibition and identification of interacting chemical groups

por GHANI, Usman, ASHRAF, Sajda, UL HAQ, Zaheer, KAPLANCIKLI, Zafer Asım, DEMİRCİ, Fatih, ÖZKAY, Yusuf, AFZAL, Sibtain
Publicado 2022

Probing CAS database as prospective antiviral agents against SARS-CoV-2 main protease

por Zia, Komal, Khan, Salman Ali, Ashraf, Sajda, Nur-e-Alam, Mohammad, Ahmed, Sarfaraz, Ul-Haq, Zaheer
Publicado 2021

Identification of Selective BRD9 Inhibitor via Integrated Computational Approach

por Ali, Maria Mushtaq, Ashraf, Sajda, Nure-e-Alam, Mohammad, Qureshi, Urooj, Khan, Khalid Mohammed, Ul-Haq, Zaheer
Publicado 2022

Phenylpyrazalopyrimidines as Tyrosine Kinase Inhibitors: Synthesis, Antiproliferative Activity, and Molecular Simulations

por Chhikara, Bhupender S., Ashraf, Sajda, Mozaffari, Saghar, St. Jeans, Nicole, Mandal, Dindyal, Tiwari, Rakesh Kumar, Ul-Haq, Zaheer, Parang, Keykavous
Publicado 2020

Synthesis and dynamics studies of barbituric acid derivatives as urease inhibitors

por Barakat, Assem, Al-Majid, Abdullah Mohammed, Lotfy, Gehad, Arshad, Fiza, Yousuf, Sammer, Choudhary, M. Iqbal, Ashraf, Sajda, Ul-Haq, Zaheer
Publicado 2015

Identification of potential TNF-α inhibitors: from in silico to in vitro studies

por Zia, Komal, Ashraf, Sajda, Jabeen, Almas, Saeed, Maria, Nur-e-Alam, Mohammad, Ahmed, Sarfaraz, Al-Rehaily, Adnan J., Ul-Haq, Zaheer
Publicado 2020

Synthesis of a New Class of Spirooxindole–Benzo[b]Thiophene-Based Molecules as Acetylcholinesterase Inhibitors

por Barakat, Assem, Alshahrani, Saeed, Al-Majid, Abdullah Mohammed, Ali, M., Altowyan, Mezna Saleh, Islam, Mohammad Shahidul, Alamary, Abdullah Saleh, Ashraf, Sajda, Ul-Haq, Zaheer
Publicado 2020

A Gene Co-Expression Network-Based Drug Repositioning Approach Identifies Candidates for Treatment of Hepatocellular Carcinoma

por Yuan, Meng, Shong, Koeun, Li, Xiangyu, Ashraf, Sajda, Shi, Mengnan, Kim, Woonghee, Nielsen, Jens, Turkez, Hasan, Shoaie, Saeed, Uhlen, Mathias, Zhang, Cheng, Mardinoglu, Adil
Publicado 2022

Synthesis, crystal structure, DFT, Hirshfeld surface analysis, energy frameworks and in-Silico drug-targeting PFKFB3 kinase of novel triazolequinoxalin derivative (TZQ) as a therap...

por Abad, Nadeem, Al-Ostoot, Fares Hezam, Ashraf, Sajda, Chkirate, Karim, Aljohani, Majed S., Alharbi, Hussam Y., Buhlak, Shafeek, El Hafi, Mohamed, Van Meervelt, Luc, Al-Maswari, Basheer M., Essassi, El Mokhtar, Ramli, Youssef
Publicado 2023

Designing Functionally Substituted Pyridine-Carbohydrazides for Potent Antibacterial and Devouring Antifungal Effect on Multidrug Resistant (MDR) Strains

por Khan, Farooq-Ahmad, Yaqoob, Sana, Ali, Shujaat, Tanveer, Nimra, Wang, Yan, Ashraf, Sajda, Hasan, Khwaja Ali, Khalifa, Shaden A. M., Shou, Qiyang, Ul-Haq, Zaheer, Jiang, Zi-Hua, El-Seedi, Hesham R.
Publicado 2022