Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 9/20 | 0.73 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.55 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.48 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.44 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | GSK3A | P49840 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18172189 | 0.85 | SCN9A (0.82) | SCN9ASCN5APTGS1TRPV1GAA | |
| SCHEMBL18172087 | 0.85 | SCN9A (1.00) | SCN9ASCN5APTGS1TRPV1GAA | |
| SCHEMBL18172223 | 0.84 | SCN9A (0.81) | SCN9ASCN5APTGS1TRPV1GAA | |
| SCHEMBL18172124 | 0.84 | SCN9A (0.81) | SCN9ASCN5APTGS1TRPV1GAA | |
| SCHEMBL18172231 | 0.83 | SCN9A (0.75) | SCN9ASCN5ADYRK1AEPHX2PTGS1 | |
| SCHEMBL18172105 | 0.82 | SCN9A (0.79) | SCN9ASCN5APTGS1TRPV1GAA | |
| SCHEMBL18172227 | 0.81 | SCN9A (0.86) | SCN9ASCN5APTGS1TRPV1GAA | |
| SCHEMBL18172209 | 0.80 | SCN9A (0.83) | SCN9ASCN5APTGS1GAANPC1 | |
| SCHEMBL18172102 | 0.80 | SCN9A (0.83) | SCN9ASCN5APTGS1GAANPC1 | |
| SCHEMBL18172090 | 0.79 | SCN9A (0.73) | SCN9ASCN5APTGS1TRPV1GAA |
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 |