Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | ACE2 | Q9BYF1 | 3/20 | 0.45 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.41 |
| ▸ | GCGR | P47871 | 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 | |
|---|---|---|---|---|
| SCHEMBL3586801 | 0.86 | ALDH1A1 (0.56) | ALDH1A1HPGDMRGPRX4 | |
| SCHEMBL6541867 | 0.84 | ALDH1A1 (0.48) | ALDH1A1HPGDACE2MRGPRX4 | |
| SCHEMBL9635251 | 0.82 | ALDH1A1 (0.47) | ALDH1A1HPGDMRGPRX4 | |
| SCHEMBL30339997 | 0.81 | ALDH1A1 (0.56) | ALDH1A1HPGD | |
| SCHEMBL403728 | 0.80 | ALDH1A1 (0.48) | ALDH1A1HPGDACE2 | |
| SCHEMBL18973195 | 0.80 | CA12 (0.45) | ALDH1A1HPGDGCGR | |
| SCHEMBL29472005 | 0.79 | ALDH1A1 (0.59) | ALDH1A1HPGDMRGPRX4 | |
| SCHEMBL4844022 | 0.79 | ALDH1A1 (0.59) | ALDH1A1HPGDMRGPRX4 | |
| SCHEMBL28343052 | 0.77 | ALDH1A1 (0.50) | ALDH1A1HPGD | |
| SCHEMBL9635254 | 0.77 | ALDH1A1 (0.48) | ALDH1A1HPGDACE2 |
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-2009053628-A2 | NOVEL COMPOUNDS, PREPARATION AND USES THEREOF | UNIVERSITE LOUIS PASTEUR (FR) | 2009-04-30 | — | — | WO | disclosed |