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: | 137-00-8 | |
|---|---|---|
| Name: | Thiamine thiozole | |
| Description: | ||
| Labels: | eval | |
| CAS: | 137-00-8 | |
| InChi Code: | InChI=1S/C6H9NOS/c1-5-6(2-3-8)9-4-7-5/h4,8H,2-3H2,1H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.019522578 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |