Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | COMT | P21964 | 5/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 5/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 4/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | THRB | P10828 | 2/20 | 0.33 |
| ▸ | RECQL | P46063 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MASP2 | O00187 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | GAPDH | P04406 | 1/20 | 0.33 |
| ▸ | HSPA1A | P0DMV8 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8041629 | 0.87 | TDP1 (0.34) | SMN1; SMN2ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL8035686 | 0.83 | COMT (0.38) | COMTSMN1; SMN2ALDH1A1MAPTHTT | |
| SCHEMBL8041268 | 0.80 | COMT (0.40) | COMTALDH1A1MAPTL3MBTL1CDK2 | |
| SCHEMBL8041245 | 0.79 | MAPT (0.39) | COMTSMN1; SMN2ALDH1A1MAPTHTT | |
| SCHEMBL8037287 | 0.78 | COMT (0.39) | COMTALDH1A1MAPTHTTMEN1 | |
| SCHEMBL8037291 | 0.76 | COMT (0.37) | COMTSMN1; SMN2ALDH1A1MAPTMEN1 | |
| SCHEMBL8035095 | 0.76 | SPR (0.38) | COMTSMN1; SMN2ALDH1A1MAPTMEN1 | |
| SCHEMBL8039069 | 0.75 | COMT (0.40) | COMTALDH1A1MAPTHTTMEN1 | |
| SCHEMBL8041264 | 0.74 | SMN1; SMN2 (0.41) | SMN1; SMN2ALDH1A1MAPTKMT2AGAA | |
| SCHEMBL7614112 | 0.72 | COMT (0.43) | COMTALDH1A1MEN1KMT2AHPGD |
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 |