Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A9 | P48067 | 19/20 | 0.82 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.61 |
| ▸ | SLC6A5 | Q9Y345 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL4424473 | 0.90 | SLC6A9 (1.00) | SLC6A9KCNH2 | |
| SCHEMBL5038280 | 0.89 | SLC6A9 (0.76) | SLC6A9KCNH2 | |
| SCHEMBL4422081 | 0.89 | SLC6A9 (0.68) | SLC6A9KCNH2SLC6A5 | |
| SCHEMBL4421243 | 0.86 | SLC6A9 (0.82) | SLC6A9KCNH2 | |
| SCHEMBL4423882 | 0.85 | SLC6A9 (0.68) | SLC6A9SLC6A5ALDH1A1HPGD | |
| SCHEMBL4421917 | 0.85 | SLC6A9 (0.68) | SLC6A9KCNH2SLC6A5ALDH1A1HPGD | |
| SCHEMBL5043267 | 0.85 | SLC6A9 (0.68) | SLC6A9KCNH2SLC6A5 | |
| SCHEMBL5042051 | 0.85 | SLC6A9 (0.68) | SLC6A9KCNH2SLC6A5 | |
| SCHEMBL4421896 | 0.85 | SLC6A9 (0.68) | SLC6A9SLC6A5ALDH1A1HPGD | |
| SCHEMBL3931193 | 0.85 | SLC6A9 (0.84) | SLC6A9SLC6A5ALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-1656361-B1 | PIPERAZINE WITH OR-SUBSTITUTED PHENYL GROUP AND THEIR USE AS GLYT1 INHIBITORS | HOFFMANN LA ROCHE (CH) | 2008-01-02 | — | — | EP | disclosed |