Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.42 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | FKBP1A | P62942 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | ACE | P12821 | 1/20 | 0.34 |
| ▸ | CTSD | P07339 | 7/20 | 0.34 |
| ▸ | CTSE | P14091 | 7/20 | 0.34 |
| ▸ | STAT6 | P42226 | 3/20 | 0.33 |
| ▸ | BACE1 | P56817 | 4/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4366593 | 0.85 | TUBB1 (0.61) | TUBB1KLK5ALOX5FKBP1AALDH1A1 | |
| SCHEMBL58756 | 0.85 | TUBB1 (0.61) | TUBB1KLK5ALOX5FKBP1AALDH1A1 | |
| SCHEMBL57941 | 0.85 | TUBB1 (0.61) | TUBB1KLK5ALOX5FKBP1AALDH1A1 | |
| SCHEMBL57912 | 0.85 | TUBB1 (0.61) | TUBB1KLK5ALOX5FKBP1AALDH1A1 | |
| SCHEMBL6260958 | 0.84 | TUBB1 (0.41) | TUBB1KLK5ALOX5FKBP1AALDH1A1 | |
| SCHEMBL4377444 | 0.83 | TUBB1 (0.58) | TUBB1KLK5FKBP1ACTSDCTSE | |
| Trifluoroacetic Acid SCHEMBL4863566 | 0.79 | XIAP (0.34) | ELANE | |
| SCHEMBL4364705 | 0.78 | TUBB1 (0.54) | TUBB1KLK5ALOX5ALDH1A1CYP3A4 | |
| SCHEMBL57416 | 0.78 | TUBB1 (0.45) | TUBB1KLK5ALOX5FKBP1AALDH1A1 | |
| SCHEMBL4368595 | 0.78 | TUBB1 (0.59) | TUBB1ACESTAT6ELANE |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005016958-A2 | COMPOUNDS FOR TREATING TUMORS | WYETH HOLDINGS CORPORATION (US) | 2005-02-24 | — | — | WO | disclosed |