Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD2 | Q9NRG4 | 2/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.44 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 8/20 | 0.43 |
| ▸ | DRD4 | P21917 | 4/20 | 0.43 |
| ▸ | DRD3 | P35462 | 6/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | CCR5 | P51681 | 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 | |
|---|---|---|---|---|
| SCHEMBL4694384 | 0.92 | SLC6A4 (0.42) | SMYD2SLC6A2SLC6A4DRD2DRD4 | |
| SCHEMBL4691761 | 0.92 | SLC6A2 (0.44) | SMYD2SLC6A2SLC6A4DRD2DRD4 | |
| SCHEMBL3284096 | 0.91 | SMYD2 (0.44) | SMYD2SLC6A2SLC6A4DRD2DRD4 | |
| SCHEMBL4693332 | 0.91 | SLC6A4 (0.45) | SMYD2SLC6A2SLC6A4P2RX7DRD2 | |
| SCHEMBL4692216 | 0.90 | SLC6A2 (0.43) | SMYD2SLC6A2SLC6A4DRD2DRD4 | |
| SCHEMBL4690664 | 0.89 | SMYD2 (0.43) | SMYD2SLC6A2SLC6A4DRD2DRD4 | |
| SCHEMBL4692997 | 0.89 | SMYD2 (0.41) | SMYD2SLC6A2SLC6A4DRD2DRD4 | |
| SCHEMBL4693959 | 0.88 | HCRTR1 (0.45) | SMYD2SLC6A2SLC6A4DRD2DRD4 | |
| SCHEMBL4691509 | 0.88 | CCR5 (0.51) | SMYD2SLC6A2SLC6A4DRD2DRD4 | |
| SCHEMBL4690666 | 0.87 | NTRK1 (0.44) | SLC6A4DRD2DRD4DRD3LMNA |
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-1761542-B1 | OCTAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES AN THEIR USE AS ANTIVIRAL AGENTS | HOFFMANN LA ROCHE (CH) | 2008-01-02 | — | — | EP | claimed |
| EP-1761542-B1 | OCTAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES AN THEIR USE AS ANTIVIRAL AGENTS | HOFFMANN LA ROCHE (CH) | 2008-01-02 | — | — | EP | disclosed |