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Paclitaxel/epothilone pharmacophore model

Winkler JD, Axelsen PH (1996) A Model for the Taxol (Paclitaxel)/Epothilone Pharmacophore. Bioorg Med Chem Lett 6 2963... [Pg.221]

Fig. 8 Overlap of the three pharmacophores representing the interactions found for paclitaxel in the 1JFF structure (A), epothilone A in the NMR-derived structure (B), and epothilone A in the QSAR model from Botta and co-workers (C), respectively. Blue C7-OH (epothilones) oxetane ring (paclitaxel) red C13 carbon (epothilones) phenyl ring (paclitaxel) yellow Cl carbonyl oxygen (epothilones) Cl carbonyl oxygen (paclitaxel) purple thiazole ring (epothilone) C3 benzamide (paclitaxel). (3-tubulin monomer is represented as a green cartoon and residues involved in hydrogen bonds are in orange (hydrogens are omitted for sake of clarity)... Fig. 8 Overlap of the three pharmacophores representing the interactions found for paclitaxel in the 1JFF structure (A), epothilone A in the NMR-derived structure (B), and epothilone A in the QSAR model from Botta and co-workers (C), respectively. Blue C7-OH (epothilones) oxetane ring (paclitaxel) red C13 carbon (epothilones) phenyl ring (paclitaxel) yellow Cl carbonyl oxygen (epothilones) Cl carbonyl oxygen (paclitaxel) purple thiazole ring (epothilone) C3 benzamide (paclitaxel). (3-tubulin monomer is represented as a green cartoon and residues involved in hydrogen bonds are in orange (hydrogens are omitted for sake of clarity)...
See other pages where Paclitaxel/epothilone pharmacophore model is mentioned: [Pg.10]    [Pg.25]    [Pg.184]    [Pg.248]    [Pg.256]    [Pg.258]    [Pg.25]    [Pg.183]    [Pg.251]    [Pg.252]    [Pg.253]    [Pg.725]   
See also in sourсe #XX -- [ Pg.25 ]



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