Predicted protein targets (top 2)
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL6052865 | 0.78 | ALDH1A1 (0.50) | ALDH1A1CYP3A4 | |
| SCHEMBL106677 | 0.74 | ALDH1A1 (0.45) | ALDH1A1CYP3A4 | |
| SCHEMBL10571330 | 0.72 | ALDH1A1 (0.44) | ALDH1A1CYP3A4 | |
| SCHEMBL8520016 | 0.72 | ALDH1A1 (0.44) | ALDH1A1CYP3A4 | |
| SCHEMBL13920839 | 0.71 | ALDH1A1 (0.42) | ALDH1A1CYP3A4 | |
| Methylamine SCHEMBL27496016 | 0.71 | ALDH1A1 (0.42) | ALDH1A1CYP3A4 | |
| SCHEMBL2762954 | 0.70 | ALDH1A1 (0.60) | ALDH1A1CYP3A4 | |
| SCHEMBL3647082 | 0.68 | ALDH1A1 (0.41) | ALDH1A1CYP3A4 | |
| SCHEMBL7914010 | 0.67 | ALDH1A1 (0.40) | ALDH1A1CYP3A4 | |
| SCHEMBL3416401 | 0.67 | ALDH1A1 (0.41) | ALDH1A1CYP3A4 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102351738-A | Method for the reduction of chlorine-containing components in organic isocyanates | LANXESS DEUTSCHLAND GMBH | 2012-02-15 | — | — | CN | disclosed |