Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.58 |
| ▸ | MME | P08473 | 3/20 | 0.50 |
| ▸ | AGTR2 | P50052 | 3/20 | 0.47 |
| ▸ | ECE1 | P42892 | 2/20 | 0.47 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.45 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.45 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.45 |
| ▸ | LTA4H | P09960 | 2/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9556665 | 0.89 | HRH4 (0.60) | HRH4MMEAGTR2ECE1PADI4 | |
| SCHEMBL7381214 | 0.84 | HRH4 (0.58) | HRH4MMEAGTR2ECE1PADI4 | |
| SCHEMBL7305090 | 0.82 | HRH4 (0.61) | HRH4AGTR2CYP19A1 | |
| SCHEMBL9556789 | 0.82 | HRH4 (0.61) | HRH4AGTR2CYP19A1 | |
| SCHEMBL7305085 | 0.82 | HRH4 (0.61) | HRH4AGTR2CYP19A1 | |
| SCHEMBL7382301 | 0.81 | HRH4 (0.54) | HRH4MMEPADI4 | |
| SCHEMBL9556344 | 0.77 | HRH4 (0.58) | HRH4CYP19A1 | |
| SCHEMBL8532853 | 0.75 | HRH4 (0.60) | HRH4CYP19A1CYP26A1 | |
| SCHEMBL6451863 | 0.72 | MME (0.54) | MMEECE1ALDH1A1LTA4H | |
| SCHEMBL6451867 | 0.72 | MME (0.54) | MMEECE1ALDH1A1LTA4H |
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 |
|---|---|---|---|---|---|---|---|
| US-5712417-A | Inhibitors of retroviral proteases | ABBOTT LABORATORIES (US) | 1998-01-27 | — | — | US | disclosed |
| EP-0428849-A2 | Retroviral protease inhibitors | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-05-29 | — | — | EP | disclosed |