Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 18/20 | 0.66 |
| ▸ | SCN5A | Q14524 | 12/20 | 0.66 |
| ▸ | KCNH2 | Q12809 | 12/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | FPR1 | P21462 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL4323000 | 0.90 | SCN9A (0.80) | SCN9ASCN5AKCNH2 | |
| SCHEMBL13577813 | 0.89 | SCN9A (0.84) | SCN9ASCN5AKCNH2SMN1; SMN2 | |
| SCHEMBL4322988 | 0.86 | SCN9A (0.64) | SCN9ASCN5AKCNH2 | |
| SCHEMBL4326444 | 0.82 | SCN9A (0.80) | SCN9ASCN5AKCNH2 | |
| SCHEMBL4318437 | 0.81 | SCN9A (0.76) | SCN9ASCN5AKCNH2 | |
| SCHEMBL13577840 | 0.80 | SCN9A (1.00) | SCN9ASCN5AKCNH2 | |
| SCHEMBL4323513 | 0.79 | SCN9A (0.81) | SCN9ASCN5AKCNH2 | |
| SCHEMBL4325794 | 0.79 | SCN9A (0.63) | SCN9ASCN5AKCNH2 | |
| SCHEMBL3751893 | 0.79 | SCN9A (0.69) | SCN9ASCN5AKCNH2 | |
| SCHEMBL4321096 | 0.78 | SCN9A (0.80) | SCN9ASCN5AKCNH2 |
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-2009145721-A1 | ISOINDOLINE DERIVATIVES COMPRISING PHENYL GROUPS AND THEIR USE IN THE TREATMENT OF PAIN DISORDERS | ASTRAZENECA AB (SE) | 2009-12-03 | — | — | WO | claimed |
| WO-2009145721-A1 | ISOINDOLINE DERIVATIVES COMPRISING PHENYL GROUPS AND THEIR USE IN THE TREATMENT OF PAIN DISORDERS | ASTRAZENECA AB (SE) | 2009-12-03 | — | — | WO | disclosed |