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: | 139-13-9 | |
|---|---|---|
| Name: | Nitrilotriacetic acid | |
| Description: | ||
| Labels: | training | |
| CAS: | 139-13-9 | |
| InChi Code: | InChI=1S/C6H9NO6/c8-4(9)1-7(2-5(10)11)3-6(12)13/h1-3H2,(H,8,9)(H,10,11)(H,12,13) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.004311725 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |