Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | CA12 | O43570 | 2/20 | 0.50 |
| ▸ | CA1 | P00915 | 2/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | CA7 | P43166 | 2/20 | 0.50 |
| ▸ | CA9 | Q16790 | 2/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | PPARA | Q07869 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4323516 | 0.86 | CA12 (0.45) | SMN1; SMN2MAPTLMNACA12CA1 | |
| SCHEMBL10455857 | 0.84 | CA12 (0.63) | SMN1; SMN2MAPTLMNACA12CA1 | |
| SCHEMBL3377099 | 0.84 | SMN1; SMN2 (0.53) | SMN1; SMN2MAPTLMNACA12CA1 | |
| SCHEMBL31051621 | 0.84 | SMN1; SMN2 (0.53) | SMN1; SMN2MAPTLMNACA12CA1 | |
| SCHEMBL1792326 | 0.83 | TSHR (0.55) | SMN1; SMN2MAPTLMNATSHRKDM4E | |
| SCHEMBL23229160 | 0.82 | ALOX5 (0.53) | MAPTLMNATSHRKDM4ECYP3A4 | |
| SCHEMBL6366424 | 0.82 | LMNA (0.54) | SMN1; SMN2MAPTLMNATSHRKDM4E | |
| SCHEMBL4331681 | 0.82 | CA12 (0.72) | SMN1; SMN2MAPTLMNACA12CA1 | |
| SCHEMBL27975261 | 0.81 | SMN1; SMN2 (0.51) | SMN1; SMN2MAPTLMNACA12CA1 | |
| SCHEMBL17061213 | 0.81 | ALDH1A1 (0.46) | SMN1; SMN2MAPTLMNATSHRKDM4E |
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 |