Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 10/20 | 0.60 |
| ▸ | SCN5A | Q14524 | 8/20 | 0.60 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.60 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.43 |
| ▸ | PTPRA | P18433 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | BRS3 | P32247 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL13568301 | 0.86 | SCN9A (0.58) | SCN9ASCN5AKCNH2TSHRKCNA5 | |
| SCHEMBL13568305 | 0.83 | SCN9A (0.49) | SCN9ASCN5AKCNH2PTPRAL3MBTL1 | |
| SCHEMBL3893189 | 0.80 | SCN9A (0.76) | SCN9ASCN5AKCNH2KCNA5 | |
| SCHEMBL3954655 | 0.80 | SCN9A (0.76) | SCN9ASCN5AKCNH2KCNA5BRS3 | |
| SCHEMBL13568405 | 0.80 | SCN9A (0.49) | SCN9ASCN5AKCNH2TSHRPTPRA | |
| SCHEMBL3891943 | 0.78 | SCN9A (0.80) | SCN9ASCN5AKCNH2KCNA5 | |
| SCHEMBL3891906 | 0.76 | SCN9A (1.00) | SCN9ASCN5AKCNH2KCNA5 | |
| SCHEMBL4322617 | 0.76 | SCN9A (0.69) | SCN9ASCN5AKCNH2KCNA5 | |
| SCHEMBL3963578 | 0.75 | SCN9A (0.72) | SCN9ASCN5AKCNH2KCNA5 | |
| SCHEMBL3959385 | 0.75 | SCN9A (0.72) | SCN9ASCN5AKCNH2KCNA5 |
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 | 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 |
| 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 |