Table 3.
Classification of unknown compounds by using discriminant analysis
Compound | Estradiol-like | 4-OH-tamoxifen-like | Raloxifene-like |
---|---|---|---|
LY88074 | 1 | 0 | 0 |
LY156681 | 0 | 0 | 0.9995 |
LY165176 | 0 | 1 | 0 |
LY117018 | 0 | 0 | 1 |
The HDX profiles of unknown compounds are fit into the cluster-analysis model, and probability of classification is calculated. 4-OH-tamoxifen, 4-hydroxytamoxifen.