Search Result "3D Pharmacophore"


Research Article

Structural Investigations of Aroylindole Derivatives through 3D-QSAR and Multiple Pharmacophore Modeling for the Search of Novel Colchicines Inhibitor

Journal: Letters in Drug Design & Discovery
Volume: 18 Issue: 2 Year: 2021 Page: 131-142
Author(s): Vijay K. Patel,Harish Rajak

Research Article

Pharmacophore-based screening for identification of Human Acyl-CoA cholesterol acyltransferase inhibitors: An in-silico study

Journal: Letters in Drug Design & Discovery
Volume: 18 Issue: 0 Year: 2021 Page: 1-14
Author(s): Shasta Kalra,Puja Kumari,Ankit Dhaundiyal

Research Article

Pharmacophore Generation, Quantitative Structure-Activity Relationship (QSAR), and Molecular Dynamic Simulation of Newly Substituted N-(6- Chloro-3-cyano-4-phenyl-4H-chromen-2-yl)-2-(4-chloro-phenoxy)-acetamide for Anticancer Activity

Journal: Current Computer-Aided Drug Design
Volume: 17 Issue: 4 Year: 2021 Page: 504-510
Author(s): Divya Chauhan,Sushil Kumar,Syed Riaz Hashim,Vinit Raj

Research Article

Discovery of Potent Natural-Product-Derived SIRT2 Inhibitors Using Structure- Based Exploration of SIRT2 Pharmacophoric Space Coupled With QSAR Analyses

Journal: Anti-Cancer Agents in Medicinal Chemistry
Volume: 21 Issue: 0 Year: 2021 Page: 1-9
Author(s): Mohammad A. Khanfar,Saja Alqtaishat

Research Article

In Silico Drug-designing Studies on Sulforaphane Analogues: Pharmacophore Mapping, Molecular Docking and QSAR Modeling

Journal: Current Drug Discovery Technologies
Volume: 18 Issue: 1 Year: 2021 Page: 139-157
Author(s): Neda Vaghefinezhad,Samaneh Fazeli Farsani,Sajjad Gharaghani

Research Article open access plus

Discovery of Structural Prospects of Imidazo[1,5-a]pyrazine Derivatives as BTK Inhibitors Against Cancer: A Computational Study

Journal: Letters in Drug Design & Discovery
Volume: 18 Issue: 0 Year: 2021 Page: 1-13
Author(s): Amena Ali,Abuzer Ali,Mohamed Jawed Ahsan

Research Article

Improved 3D-QSAR Prediction by Multiple Conformational Alignments and Molecular Docking Studies to Design and Discover HIV-I Protease Inhibitors

Journal: Current HIV Research
Volume: 19 Issue: 2 Year: 2021 Page: 154-171
Author(s): Paresh K. Patel,Hardik G. Bhatt

Research Article

A Combined Approach of Pharmacophore Modeling, QSAR Study, Molecular Docking and In silico ADME/Tox Prediction of 4-Arylthio & 4-Aryloxy-3- Iodopyridine-2(1H)-one Analogs to identify Potential Reverse Transcriptase Inhibitor: Anti-HIV Agents

Journal: Medicinal Chemistry
Volume: 17 Issue: 0 Year: 2021 Page: 1-37
Author(s): Debadash Panigrahi,Amiyakanta Mishra,Susanta Kumar Sahu,Mohd. Afzal Azam,C.M. Vyshaag

Research Article

Petra/Osiris/Molinspiration and Molecular Docking Analyses of 3-Hydroxy-Indolin-2-one Derivatives as Potential Antiviral Agents

Journal: Current Computer-Aided Drug Design
Volume: 17 Issue: 1 Year: 2021 Page: 123-133
Author(s): Taibi Ben Hadda,Vesna Rastija,Faisal AlMalki,Abderrahim Titi,Rachid Touzani,Yahia N. Mabkhot,Shah Khalid,Abdelkader Zarrouk,Bina S. Siddiqui

Review Article

Thiazolidinedione: A Privileged Scaffold for the Development of Anticancer Agents

Journal: Current Topics in Medicinal Chemistry
Volume: 21 Issue: 0 Year: 2021 Page: 1-17
Author(s): Juan Sun,Yue-Hu Chen,Han-Yu Liu,Emmerson Hondo,Yang Zhou,Yuan-Feng Wu

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