Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.41 |
| ▸ | NAAA | Q02083 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8037444 | 1.00 | EPHX2 (0.43) | EPHX2PDE10ANAAA | |
| SCHEMBL8037440 | 0.99 | PDE10A (0.42) | EPHX2PDE10A | |
| SCHEMBL8037435 | 0.96 | PDE10A (0.41) | PDE10A | |
| SCHEMBL8037415 | 0.91 | S1PR1 (0.41) | — | |
| SCHEMBL8037394 | 0.89 | POLB (0.46) | — | |
| SCHEMBL8035725 | 0.87 | KDM4E (0.43) | — | |
| SCHEMBL8025554 | 0.85 | MTNR1A (0.42) | — | |
| SCHEMBL8035132 | 0.85 | S1PR1 (0.38) | — | |
| SCHEMBL8041325 | 0.84 | ALDH1A1 (0.45) | — | |
| SCHEMBL8025601 | 0.82 | TRPV1 (0.48) | PDE10ANAAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009081892-A1 | NOVEL CATECHOL DERIVATIVE, PHARMACEUTICAL COMPOSITION CONTAINING THE SAME, AND USE OF THOSE | KISSEI PHARMACEUTICAL CO., LTD. (JP) | 2009-07-02 | — | — | WO | disclosed |