- De novo design and synthesis of HIV-1 integrase inhibitorsMahindra T Makhija
Pharmaceutical Division, Department of Chemical Technology, University of Mumbai, Matunga, Mumbai 400019, India
Bioorg Med Chem 12:2317-33. 2004..Nonetheless, these compounds possess structural features not seen in known HIV-1 integrase inhibitors and thus can serve as excellent leads for further optimization of anti-HIV-1 integrase activity...
- 3D-QSAR and molecular modeling of HIV-1 integrase inhibitorsMahindra T Makhija
Department of Chemical Technology, University of Mumbai, Matunga, India
J Comput Aided Mol Des 16:181-200. 2002..The binding site was formed by the amino acid residues 64-67, 116, 148, 151-152, 155-156, and 159. The comparison of coefficient contour maps with the steric and electrostatic properties of the receptor shows high level of compatibility...
- QSAR of HIV-1 integrase inhibitors by genetic function approximation methodMahindra T Makhija
Pharmaceutical Division, Department of Chemical Technology, University of Mumbai, Mumbai 400 019, Matunga, India
Bioorg Med Chem 10:1483-97. 2002..Models generated for catechols show that electronic, shape related, and thermodynamic parameters are important whereas for noncatechols, spatial, structural, and thermodynamic properties play an important role for the activity...
- Designing HIV integrase inhibitors--shooting the last arrowMahindra T Makhija
West Australian Biomedical Research Institute, School of Biomedical Sciences, Curtin University of Technology, Kent Street, Bentley, WA 6102, Australia
Curr Med Chem 13:2429-41. 2006..This review details the existing knowledge of the biological functions of the HIV-1 integrase with the focus on its available inhibitors, their disadvantages, and the current trends in designing novel compounds as anti-integrase...