Article Figures & Data
Additional Files
Data Supplement
Files in this Data Supplement:
- Supplemental Data -
Supplemental Figure 1 - Bland-Altman plots for the pair-wise comparisons of the inhibition of MATE1-mediate transport of MPP, NBD-MTMA, cimetidine and metformin produced by 50 mu-M concentrations of the 400 test compounds from the NCC
Supplemental Figure 2
Supplemental Figure 3 - Comparison of the inhibition of MATE1-mediated transport of 3HMPP resulting from exposure to a 50 mu-M concentration of 86 compounds from the NCC...
Supplemental Figure 4 - N32 Pharmacophore for MPP
Supplemental Figure 5 - Good features in the consensus MATE1 Bayesian model
Supplemental Table 1 - Pharmacophore predictions
Supplemental Table 2 - Assessment of the DDI potential for selected drugs based on their unbound Cmax values and their IC50 for inhibition of MATE1-mediated transport
Supplemental Table 3 - Bayesian models statistics using Discovery Studio and CDD Models for the 400 molecules
Supplemental Table 4 - Bayesian models statistics using Discovery Studio for the 26 molecules
- Supplemental Data -