Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 5/20 | 0.47 |
| ▸ | CES1 | P23141 | 5/20 | 0.47 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | ERN1 | O75460 | 1/20 | 0.39 |
| ▸ | ALB | P02768 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 1/20 | 0.34 |
| ▸ | PPARA | Q07869 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | GLS | O94925 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | TTR | P02766 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1550396 | 0.79 | CES2 (0.44) | CES2CES1BCHEERN1ALB | |
| SCHEMBL8523806 | 0.79 | POLB (0.43) | ERN1 | |
| SCHEMBL31407025 | 0.76 | CES2 (0.66) | CES2CES1BCHEALBGAA | |
| SCHEMBL31407017 | 0.76 | CES2 (0.66) | CES2CES1BCHEALBGAA | |
| SCHEMBL1668559 | 0.76 | CES2 (0.66) | CES2CES1BCHEALBGAA | |
| SCHEMBL23972274 | 0.76 | CES2 (0.66) | CES2CES1BCHEALBGAA | |
| SCHEMBL4418499 | 0.76 | CES2 (0.51) | CES2CES1BCHEALBGAA | |
| SCHEMBL1668558 | 0.76 | CES2 (0.66) | CES2CES1BCHEALBGAA | |
| SCHEMBL6491103 | 0.76 | CES2 (0.51) | CES2CES1BCHEHPGD | |
| SCHEMBL8583188 | 0.74 | CES2 (0.50) | CES2CES1BCHEALBGAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0840614-A1 | CALPAIN INHIBITORS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES | SANOFI WINTHROP, INC. (US) | 1998-05-13 | — | — | EP | disclosed |
| WO-1996041638-A1 | CALPAIN INHIBITORS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES | SANOFI WINTHROP, INC. (US) | 1996-12-27 | — | — | WO | disclosed |