Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 18/20 | 0.64 |
| ▸ | KCNH2 | Q12809 | 13/20 | 0.64 |
| ▸ | SCN5A | Q14524 | 12/20 | 0.64 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.44 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.44 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4322617 | 0.85 | SCN9A (0.69) | SCN9AKCNH2SCN5AKCNA5KCNQ2 | |
| SCHEMBL13579072 | 0.84 | SCN9A (0.73) | SCN9AKCNH2SCN5AKCNA5KCNQ2 | |
| SCHEMBL4334652 | 0.83 | SCN9A (0.54) | SCN9AKCNH2SCN5AKCNA5KCNQ2 | |
| SCHEMBL3954655 | 0.79 | SCN9A (0.76) | SCN9AKCNH2SCN5AKCNA5KCNQ2 | |
| SCHEMBL3893189 | 0.79 | SCN9A (0.76) | SCN9AKCNH2SCN5AKCNA5KCNQ2 | |
| SCHEMBL3891943 | 0.79 | SCN9A (0.80) | SCN9AKCNH2SCN5AKCNA5KCNQ2 | |
| SCHEMBL3891906 | 0.78 | SCN9A (1.00) | SCN9AKCNH2SCN5AKCNA5KCNQ2 | |
| SCHEMBL4452741 | 0.76 | LNPEP (0.36) | SCN9AKCNH2SCN5A | |
| SCHEMBL3963578 | 0.75 | SCN9A (0.72) | SCN9AKCNH2SCN5AKCNA5KCNQ2 | |
| SCHEMBL3959385 | 0.75 | SCN9A (0.72) | SCN9AKCNH2SCN5AKCNA5KCNQ2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009145720-A1 | ISOINDOLINE DERIVATIVES COMPRISING ADDITIONAL HETEROCYCLIC GROUPS AND THEIR USE IN THE TREATMENT OF PAIN DISORDERS | ASTRAZENECA AB (SE) | 2009-12-03 | — | — | WO | claimed |
| WO-2009145720-A1 | ISOINDOLINE DERIVATIVES COMPRISING ADDITIONAL HETEROCYCLIC GROUPS AND THEIR USE IN THE TREATMENT OF PAIN DISORDERS | ASTRAZENECA AB (SE) | 2009-12-03 | — | — | WO | disclosed |
| WO-2009145720-A1 | ISOINDOLINE DERIVATIVES COMPRISING ADDITIONAL HETEROCYCLIC GROUPS AND THEIR USE IN THE TREATMENT OF PAIN DISORDERS | ASTRAZENECA AB (SE) | 2009-12-03 | — | — | WO | disclosed |