Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 6/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.35 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8035095 | 0.89 | SPR (0.38) | SMN1; SMN2MAPTHSP90AA1ALDH1A1LMNA | |
| SCHEMBL8038657 | 0.88 | POLB (0.40) | MAPTALDH1A1KMT2A | |
| SCHEMBL8041621 | 0.77 | MEN1 (0.40) | SMN1; SMN2MAPTALDH1A1LMNAKMT2A | |
| SCHEMBL8035686 | 0.76 | COMT (0.38) | SMN1; SMN2MAPTHSP90AA1PKMALDH1A1 | |
| SCHEMBL8037287 | 0.76 | COMT (0.39) | MAPTALDH1A1LMNAKMT2ATSHR | |
| SCHEMBL8041271 | 0.74 | COMT (0.35) | SMN1; SMN2MAPTHSP90AA1PKMALDH1A1 | |
| SCHEMBL8039069 | 0.73 | COMT (0.40) | MAPTHSP90AA1ALDH1A1LMNAKMT2A | |
| SCHEMBL8041268 | 0.73 | COMT (0.40) | MAPTALDH1A1 | |
| SCHEMBL7614112 | 0.70 | COMT (0.43) | ALDH1A1KMT2ATSHR | |
| SCHEMBL8039106 | 0.70 | POLB (0.45) | SMN1; SMN2MAPTPKMALDH1A1LMNA |
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 |