## Predicted Developmental Toxicity for 117-39-5 from FDA method

Prediction results
Endpoint | Experimental value | Predicted value
--- | --- | ---
Developmental Toxicity value | N/A | 1,06
Developmental Toxicity result | N/A | Developmental toxicant

Cluster model predictions and statistics
Cluster model | Test chemical descriptor values | Predicted value | Concordance | Sensitivity | Specificity | #chemicals
--- | --- | --- | --- | --- | --- | ---
FDA model | Descriptors | 1,06 | 0,967 | 1,000 | 0,875 | 30

Test chemical

Descriptor values for test chemical

## Predictions for the test chemical and for the most similar chemicals in the external test set

### If similar test set chemicals were predicted well relative to the entire test set, one has greater confidence in the predicted value.

Prediction statistics for similar chemicals
Concordance | Sensitivity | Specificity
--- | --- | ---
0,00 (0 out of 1) | N/A | 0,00 (0 out of 1)

CAS | Structure | Similarity Coefficient | Experimental value | Predicted value
--- | --- | --- | --- | ---
117-39-5 (test chemical) |  |  | N/A | 1,06
13392-18-2 |  | 0,57 | 0,00 | 0,75

## Predictions for the test chemical and for the most similar chemicals in the training set

Note: No chemicals in the training set exceed a minimum similarity coefficient of 0.5 for comparison purposes