WhichCyp 1.2

Predicts binding to Cyp isophorms: 1A2, 2C9, 2C19, 2D6 and 3A4.
Interpretation of predictions taken from WhichCyp details

Binder{isophorm}: Value of 1 indicates likely to bind

Atom highlighting: highlight the fragment which was most significant in the model's decision to predict it as binding or non-binding.

Sensitivity warning: This means that the molecule is different enough from the training data that we are uncertain about the model's applicability.

Options

Structure

A column which can provide a structure for the CDK Adapter

Image settings

Width

The width of the result render

Height

The height of the result render

Image format

Options available for rendering PNG and SVG cells using the CDK Depict functionality

Colour

The colour to use for all site highlights (regardless of rank).

Use sensitivity for colouring

If checked the highlight will override with gray if the sensitivity warning is set

Label colour

The colour for the label (if any is added)

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