Please note that binding site 3 prediction is not included in the built in SVM model.
Calculated physicochemical properties:
Ghose-Viswanadhan-Wendoloski antiinflammatory-like index
number of carboxylic acids (aliphatic)
number of substituted benzene C(sp2)
In the following tables the similarities of the query compound to the original X-Ray compunds are presented. Similarity is calculated based on Tanimoto fingerprints. The value ranges from 0 to 1, with 1 being identical to the original X-Ray compound.