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: | 34580-13-7 | |
|---|---|---|
| Name: | Ketotifen | |
| Description: | ||
| Labels: | eval | |
| CAS: | 34580-13-7 | |
| InChi Code: | InChI=1S/C19H19NOS/c1-20-9-6-13(7-10-20)18-15-5-3-2-4-14(15)12-17(21)19-16(18)8-11-22-19/h2-5,8,11H,6-7,9-10,12H2,1H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.170943724 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |