Name
Title | ||
|---|---|---|
Pharmacophore modeling, virtual screening and molecular docking of ATPase inhibitors of HSP70. |
Abstract | ||
|---|---|---|
•Heat shock protein 70 is an effective anticancer target as it influences many signaling pathways.•Key pharmacophore features required for ATPase inhibitory activity of HSP70 were identified by ligand based pharmacophore model.•The identified most extrapolative pharmacophore model (hypotheses 8), consisted of four hydrogen bond acceptors.•Three Phytochemical compounds and a synthetic drug were obtained as leads in the inhibition of ATPase activity of HSP70. |
Year | DOI | Venue |
|---|---|---|
2017 | 10.1016/j.compbiolchem.2017.05.011 | Computational Biology and Chemistry |
Keywords | Field | DocType |
HSP 70,Pharmacophore modeling,Virtual screening,Molceular Docking | Docking (molecular),Pharmacophore,Discovery Studio,ATPase,Ligand,Combinatorial chemistry,Chemistry,Bioinformatics,Lipinski's rule of five,Virtual screening,Hydrogen bond | Journal |
Volume | Issue | ISSN |
70 | C | 1476-9271 |
Citations | PageRank | References |
1 | 0.37 | 1 |
Authors | ||
3 | ||
Name | Order | Citations | PageRank |
|---|---|---|---|
| K. Sangeetha | 1 | 1 | 0.37 |
| R. P. Sasikala | 2 | 1 | 0.37 |
| M. V. P. Kumar | 3 | 21 | 3.98 |