Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 5/20 | 0.60 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.60 |
| ▸ | MAOA | P21397 | 1/20 | 0.60 |
| ▸ | GSK3B | P49841 | 1/20 | 0.46 |
| ▸ | BACE1 | P56817 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6690644 | 1.00 | MAOB (0.60) | MAOBSCN9AMAOAGSK3BBACE1 | |
| SCHEMBL27679061 | 0.85 | MAOB (0.55) | MAOBSCN9AMAOA | |
| SCHEMBL964393 | 0.80 | MAOB (0.80) | MAOBSCN9AMAOA | |
| SCHEMBL963317 | 0.79 | MAOB (0.78) | MAOBSCN9AMAOA | |
| SCHEMBL5133922 | 0.76 | MAOB (0.76) | MAOBSCN9AMAOA | |
| Hydrochloric Acid SCHEMBL8614399 | 0.75 | SMN1; SMN2 (0.45) | — | |
| Safinamide SCHEMBL194169 | 0.75 | MAOB (1.00) | MAOBSCN9AMAOA | |
| Safinamide SCHEMBL29358109 | 0.75 | MAOB (1.00) | MAOBSCN9AMAOA | |
| Safinamide SCHEMBL69351 | 0.75 | MAOB (1.00) | MAOBSCN9AMAOA | |
| Safinamide SCHEMBL69350 | 0.75 | MAOB (1.00) | MAOBSCN9AMAOA |
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-2004087125-A1 | AMINO ACID DERIVATIVES AS INHIBITORS OF MAMMALIAN SODIUM CHANNELS | IONIX PHARMACEUTICALS LIMITED (GB) | 2004-10-14 | — | — | WO | disclosed |