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: | 117-39-5 | |
|---|---|---|
| Name: | Quercetin | |
| Description: | ||
| Labels: | training | |
| CAS: | 117-39-5 | |
| InChi Code: | InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.382811555 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |