Pharmacophore identification of alpha(1A)-adrenoceptor antagonists.
Article Details
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Li MY, Tsai KC, Xia L
Pharmacophore identification of alpha(1A)-adrenoceptor antagonists.
Bioorg Med Chem Lett. 2005 Feb 1;15(3):657-64.
- PubMed ID
- 15664832 [ View in PubMed]
- Abstract
A chemical feature based pharmacophore model was developed for alpha(1A)-adrenoceptor antagonists by HypoGen module implemented in catalyst software package. The best scoring pharmacophore hypothesis, Hypo1, consisted of four important chemical features (one positive ion, one hydrogen-bond donor, one aromatic ring, and one hydrophobic group). The results of our study provide a valuable tool in designing new leads with desired biological activity by virtual screening.
DrugBank Data that Cites this Article
- Binding Properties
Drug Target Property Measurement pH Temperature (°C) Silodosin Alpha-1A adrenergic receptor Ki (nM) 0.036 N/A N/A Details Tamsulosin Alpha-1A adrenergic receptor Ki (nM) 0.2 N/A N/A Details