Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 20/20 | 0.80 |
| ▸ | SCN5A | Q14524 | 15/20 | 0.80 |
| ▸ | KCNH2 | Q12809 | 14/20 | 0.80 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.58 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.58 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL3903558 | 0.92 | SCN9A (0.81) | SCN9ASCN5AKCNH2KCNQ2KCNA5 | |
| SCHEMBL3891906 | 0.89 | SCN9A (1.00) | SCN9ASCN5AKCNH2KCNQ2KCNA5 | |
| SCHEMBL3893474 | 0.86 | SCN9A (1.00) | SCN9ASCN5AKCNH2KCNQ2KCNA5 | |
| SCHEMBL3889673 | 0.82 | SCN9A (0.84) | SCN9ASCN5AKCNH2KCNQ2KCNA5 | |
| SCHEMBL13568305 | 0.80 | SCN9A (0.49) | SCN9ASCN5AKCNH2 | |
| SCHEMBL3888273 | 0.79 | SCN9A (1.00) | SCN9ASCN5AKCNH2KCNQ2KCNA5 | |
| SCHEMBL3891943 | 0.78 | SCN9A (0.80) | SCN9ASCN5AKCNH2KCNQ2KCNA5 | |
| SCHEMBL13568302 | 0.77 | SCN9A (0.46) | SCN9ASCN5AKCNH2 | |
| SCHEMBL3893487 | 0.76 | SCN9A (1.00) | SCN9ASCN5AKCNH2KCNQ2KCNA5 | |
| SCHEMBL3897243 | 0.76 | SCN9A (1.00) | SCN9ASCN5AKCNH2KCNQ2KCNA5 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009145718-A1 | ISOINDOLINE DERIVATIVES COMPRISING AN ADDITIONAL HETEROCYCLIC GROUP AND THEIR USE IN THE TREATMENT OF PAIN DISORDERS | ASTRAZENECA AB (SE) | 2009-12-03 | — | — | WO | disclosed |
| WO-2009145718-A1 | ISOINDOLINE DERIVATIVES COMPRISING AN ADDITIONAL HETEROCYCLIC GROUP AND THEIR USE IN THE TREATMENT OF PAIN DISORDERS | ASTRAZENECA AB (SE) | 2009-12-03 | — | — | WO | disclosed |