Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8080990 | 1.00 | MAPK1 (0.33) | MAPK1GPR119HRH3 | |
| SCHEMBL8329381 | 0.77 | NOS3 (0.38) | MAPK1HRH3 | |
| SCHEMBL5902243 | 0.75 | — | — | |
| SCHEMBL30114557 | 0.75 | MAPK1 (0.33) | MAPK1HRH3 | |
| Hydrochloric Acid SCHEMBL7446749 | 0.75 | NOS3 (0.40) | MAPK1HRH3 | |
| SCHEMBL1903969 | 0.67 | MAPK1 (0.36) | MAPK1GPR119HRH3 | |
| SCHEMBL23182892 | 0.66 | KDM4E (0.35) | — | |
| SCHEMBL17646713 | 0.66 | KDM4E (0.35) | — | |
| SCHEMBL1901073 | 0.63 | GAA (0.35) | MAPK1HRH3 | |
| SCHEMBL4200760 | 0.63 | GAA (0.35) | MAPK1HRH3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1037905-A1 | ANTIPICORNAVIRAL COMPOUNDS AND METHODS FOR THEIR USE AND PREPARATION | AGOURON PHARMACEUTICALS, INC. (US) | 2000-09-27 | — | — | EP | disclosed |
| US-5962487-A | PICORNAVIRAL 3C PROTEASE INHIBITORS | AGOURON PHARMACEUTICALS, INC. (US) | 1999-10-05 | — | — | US | disclosed |
| WO-1999031122-A9 | ANTIPICORNAVIRAL COMPOUNDS AND METHODS FOR THEIR USE AND PREPARATION | AGOURON PHARMA (US) | 1999-09-30 | — | — | WO | disclosed |
| WO-1999031122-A1 | ANTIPICORNAVIRAL COMPOUNDS AND METHODS FOR THEIR USE AND PREPARATION | AGOURON PHARMACEUTICALS, INC. (US) | 1999-06-24 | — | — | WO | disclosed |