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: | 59721-29-8 | |
|---|---|---|
| Name: | Camostat mesylate | |
| Description: | ||
| Labels: | eval | |
| CAS: | 59721-29-8 | |
| InChi Code: | InChI=1S/C20H22N4O5/c1-24(2)17(25)12-28-18(26)11-13-3-9-16(10-4-13)29-19(27)14-5-7-15(8-6-14)23-20(21)22/h3-10H,11-12H2,1-2H3,(H4,21,22,23) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.066910041 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |