Garcia-Sosa, A. T.; Maran, U. Using combined docking, chemical fingerprints, and Bayesian classifiers for the androgen receptor binding activity of the CoMPARA data. Toxicological Sciences 2020.
Compound
| ID: | 139149-55-6 | |
|---|---|---|
| Name: | SB202235 | |
| Description: | ||
| Labels: | training | |
| CAS: | 139149-55-6 | |
| InChi Code: | InChI=1S/C16H16N2O4/c17-16(19)18(20)14-10-22-15-8-12(6-7-13(14)15)21-9-11-4-2-1-3-5-11/h1-8,14,20H,9-10H2,(H2,17,19)/t14-/m1/s1 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.449481716 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |