Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.76 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.76 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.76 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.76 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.53 |
| ▸ | REN | P00797 | 2/20 | 0.49 |
| ▸ | CTSD | P07339 | 7/20 | 0.48 |
| ▸ | CTSE | P14091 | 7/20 | 0.48 |
| ▸ | BACE1 | P56817 | 6/20 | 0.48 |
| ▸ | ACE | P12821 | 4/20 | 0.47 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.46 |
| ▸ | CMA1 | P23946 | 1/20 | 0.45 |
| ▸ | F2 | P00734 | 1/20 | 0.44 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.44 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | CASP3 | P42574 | 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 | |
|---|---|---|---|---|
| SCHEMBL7385499 | 1.00 | ADORA3 (0.76) | ADORA3ADORA2AADORA2BADORA1KLK5 | |
| SCHEMBL7388528 | 1.00 | ADORA3 (0.76) | ADORA3ADORA2AADORA2BADORA1KLK5 | |
| SCHEMBL7387242 | 0.98 | ADORA3 (0.73) | ADORA3ADORA2AADORA2BADORA1KLK5 | |
| SCHEMBL7384430 | 0.93 | ADORA3 (0.65) | ADORA3ADORA2AADORA2BADORA1KLK5 | |
| SCHEMBL7384427 | 0.93 | ADORA3 (0.65) | ADORA3ADORA2AADORA2BADORA1KLK5 | |
| SCHEMBL7385443 | 0.93 | ADORA3 (0.66) | ADORA3ADORA2AADORA2BADORA1KLK5 | |
| SCHEMBL7386100 | 0.92 | ADORA3 (0.65) | ADORA3ADORA2AADORA2BADORA1KLK5 | |
| SCHEMBL7386097 | 0.92 | ADORA3 (0.65) | ADORA3ADORA2AADORA2BADORA1KLK5 | |
| SCHEMBL7387620 | 0.92 | ADORA3 (0.64) | ADORA3ADORA2AADORA2BADORA1KLK5 | |
| SCHEMBL7387622 | 0.92 | ADORA3 (0.64) | ADORA3ADORA2AADORA2BADORA1KLK5 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0498680-A1 | New beta-amino-alpha-hydroxycarboxylic acids and their use | Sankyo Company Limited (JP) | 1992-08-12 | — | — | EP | disclosed |