Table 4.
Probabilities that OLAs are substrates (s) and inhibitors (i) of the human cytochromes (CYP) involved in the metabolism of xenobiotics. The values in this table represent the probabilities that investigated oligomers are (positive values) or are not (negative values) substrates or inhibitors of cytochromes. The notation ”u” refers to the number of the monomers in the oligomer.
| Tool/ Cytochrom/ Oligomer | OLA 1u | OLA 2u | OLA 3u - OLA 40u | |
|---|---|---|---|---|
| admetSAR | CYP3A4s | -0.84 | -0.71 | -0.69 |
| CYP2C9s | 0.60 | 0.60 | 0.60 | |
| CYPSD6s | -0.87 | -0.88 | -0.88 | |
| CYP3A4i | -0.98 | -0.97 | -0.95 | |
| CYP2C9i | -0.88 | -0.91 | -0.93 | |
| CYP2C19i | -0.98 | -0.96 | -0.97 | |
| CYP2D6i | -0.98 | -0.96 | -0.95 | |
| CYP1A2i | -0.97 | -0.98 | -0.98 | |
| Swiss ADME |
CYP3A4i | No | No | No |
| CYP2C9i | No | No | No | |
| CYP2C19i | No | No | No | |
| CYP2D6i | No | No | No | |
| CYP1A2i | No | No | No | |