SIMCOMP Search
SUBCOMP
SIMCOMP
SIMCOMP2
API
KEGG2
Enter query compound:
(in one of the four forms)
Compound ID
(Example) C00022
MOL File Name
MOL File Text
SMILES
Select target database:
COMPOUND
DRUG
KNApSAcK
REACTION
Search options:
Global search
Local search
Customized search
Option details
Docking mode
Atom based
Bond based
(Matching by
Atom species
Atom class
KEGG atom)
Post-processing mode
None
for the largest SCCS
for all SCCSs
(Matching by
Atom species
Atom class
KEGG atom)
Chiral check
Off
SIMCOMP help
SIMCOMP REST API
Download KegDraw
KegDraw is a Java application for drawing compound structure.
Feedback
KEGG
GenomeNet
Kyoto University Bioinformatics Center
