Three-dimensional common-feature hypotheses for hypoglycemic flavonyl-2,4-thiazolidinedione derivatives

YILDIZ İ., BOZDAĞ DÜNDAR O.

MEDICINAL CHEMISTRY RESEARCH, cilt.19, sa.3, ss.211-219, 2010 (SCI-Expanded) identifier identifier

  • Yayın Türü: Makale / Tam Makale
  • Cilt numarası: 19 Sayı: 3
  • Basım Tarihi: 2010
  • Doi Numarası: 10.1007/s00044-009-9185-9
  • Dergi Adı: MEDICINAL CHEMISTRY RESEARCH
  • Derginin Tarandığı İndeksler: Science Citation Index Expanded (SCI-EXPANDED), Scopus
  • Sayfa Sayıları: ss.211-219
  • Anahtar Kelimeler: Pharmacophore analysis, HipHop, Hypoglycemic agents, 2,4-thiazolidinediones, 2,4-imidazolidinediones, 2-thiohydantoin, Flavone, CONFORMATIONAL COVERAGE, FLAVONE DERIVATIVES, AGENT CS-045, COMMUNICATION, PATHOGENESIS, NIDDM
  • Ankara Üniversitesi Adresli: Evet

Özet

Three-dimensional pharmacophore hypotheses were built from a set of seven antidiabetic agents. Among the ten commonly featured models generated by program Catalyst/HipHop, a hypothesis including four hydrogen-bond acceptors (HBAs) and two hydrophobic aromatics (HpArs) features was considered to be important in evaluating the hypoglycemic activity. The most active 3-ethyl-5-[3'-(4H-4-oxo-1-benzopyran-2-yl)benzylidene]-2,4-thiazolidinedione (4b) mapped well onto all the HBAs and HpArs features of the hypothesis.