Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 2/20 | 0.53 |
| ▸ | MAOB | P27338 | 2/20 | 0.50 |
| ▸ | MAOA | P21397 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6689254 | 1.00 | SCN9A (0.53) | SCN9AMAOBMAOAPOLBHPGD | |
| SCHEMBL6687637 | 0.87 | MAOB (0.57) | SCN9AMAOBMAOAPOLBHPGD | |
| SCHEMBL6689985 | 0.86 | SCN9A (0.48) | SCN9AMAOBMAOAPOLBHPGD | |
| SCHEMBL6689984 | 0.86 | SCN9A (0.48) | SCN9AMAOBMAOAPOLBHPGD | |
| SCHEMBL6688726 | 0.85 | CD274 (0.45) | POLB | |
| SCHEMBL6688731 | 0.85 | CD274 (0.45) | POLB | |
| SCHEMBL6685476 | 0.84 | MAOB (0.47) | SCN9AMAOBMAOAPOLB | |
| SCHEMBL6685482 | 0.84 | MAOB (0.47) | SCN9AMAOBMAOAPOLB | |
| SCHEMBL6690764 | 0.83 | PDCD1 (0.46) | — | |
| SCHEMBL6688736 | 0.80 | SCN9A (0.77) | SCN9AMAOBMAOA |
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 |