MetaPrint2D

metabolic site predictor

Query Structure

Enter SMILES string:

Advanced options

Fingerprint matching

Set the similarity strictness of the fingerprint matching:

Loose (2, 1.0, 1.0, 1.0, 1.0, 0.75, 0.5, 0.25)
Default (3, 0.5, 1.0, 1.0, 1.0, 0.75, 0.5, 0.25)
Strict (4, 0.1, 1.0, 1.0, 1.0, 1.0, 0.5, 0.25)
Custom (set the values below)
Number of exact levels:
Similarity threshold:
First weight:
Second weight:
Third weight:
Fourth weight:
Fifth weight:
Sixth weight:

Model

Select model:

ALL (Metabolite 2010.2)
DOG (Metabolite 2010.2)
HUMAN (Metabolite 2010.2)
RAT (Metabolite 2010.2)