Scaffold hopping from synthetic RXR modulators by virtual screening and de novo design.
Medchemcomm
; 9(8): 1289-1292, 2018 Aug 01.
Article
in En
| MEDLINE
| ID: mdl-30151082
ABSTRACT
The lack of potent subtype-selective modulators of retinoid X receptors (RXRs) has hindered their full exploitation as promising drug targets. Using computational similarity searching, target prediction and automated de novo design, we identified novel RXR ligands exhibiting innovative molecular frameworks, pronounced receptor-subtype preference and suitable properties for hit-to-lead expansion.
Full text:
1
Collection:
01-internacional
Database:
MEDLINE
Type of study:
Diagnostic_studies
/
Screening_studies
Language:
En
Journal:
Medchemcomm
Year:
2018
Document type:
Article