Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 10/20 | 0.81 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.60 |
| ▸ | WNT3A | P56704 | 1/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.48 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.43 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL18172087 | 0.89 | SCN9A (1.00) | SCN9ASCN5AWNT3APTGS1GAA | |
| SCHEMBL18172189 | 0.89 | SCN9A (0.82) | SCN9ASCN5AWNT3APTGS1GAA | |
| SCHEMBL18172219 | 0.89 | SCN9A (0.70) | SCN9ASCN5AWNT3APTGS1RPS6KA3 | |
| SCHEMBL18172223 | 0.89 | SCN9A (0.81) | SCN9ASCN5AWNT3APTGS1GAA | |
| SCHEMBL18172102 | 0.88 | SCN9A (0.83) | SCN9ASCN5AWNT3APTGS1GAA | |
| SCHEMBL18172185 | 0.87 | SCN9A (0.75) | SCN9ASCN5AWNT3ANPC1RAB9A | |
| SCHEMBL18172105 | 0.87 | SCN9A (0.79) | SCN9ASCN5APTGS1GAATRPV1 | |
| SCHEMBL18172108 | 0.87 | SCN9A (0.67) | SCN9ASCN5AWNT3APTGS1RPS6KA3 | |
| SCHEMBL18172170 | 0.86 | SCN9A (0.74) | SCN9ASCN5AWNT3APTGS1RPS6KA3 | |
| SCHEMBL18172227 | 0.86 | SCN9A (0.86) | SCN9ASCN5AWNT3APTGS1GAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3286178-A1 | AMINO-SUBSTITUTED HETEROCYCLIC DERIVATIVES AS SODIUM CHANNEL INHIBITORS | Almirall S.A. (ES) | 2018-02-28 | — | — | EP | disclosed |
| WO-2016170009-A1 | AMINO-SUBSTITUTED HETEROCYCLIC DERIVATIVES AS SODIUM CHANNEL INHIBITORS | ALMIRALL, S.A. (ES) | 2016-10-27 | — | — | WO | disclosed |