Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 12/20 | 0.36 |
| ▸ | HCRTR2 | O43614 | 12/20 | 0.36 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.34 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | CCR5 | P51681 | 2/20 | 0.34 |
| ▸ | KCNK3 | O14649 | 2/20 | 0.33 |
| ▸ | KCNK9 | Q9NPC2 | 2/20 | 0.33 |
| ▸ | NAMPT | P43490 | 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 | |
|---|---|---|---|---|
| SCHEMBL4689903 | 0.89 | P2RX7 (0.41) | ALDH1A1THRBCCR5 | |
| SCHEMBL4691802 | 0.83 | CCR5 (0.48) | HCRTR1HCRTR2ALDH1A1CCR5 | |
| SCHEMBL4695117 | 0.82 | HDAC3 (0.41) | HCRTR1HCRTR2NAMPT | |
| SCHEMBL4694289 | 0.81 | HCRTR1 (0.51) | HCRTR1HCRTR2 | |
| SCHEMBL4694309 | 0.81 | HCRTR1 (0.39) | HCRTR1HCRTR2 | |
| SCHEMBL4694455 | 0.81 | CHRNB2 (0.44) | ALDH1A1CCR5 | |
| SCHEMBL4694264 | 0.80 | ALDH1A1 (0.36) | HCRTR1HCRTR2ALDH1A1CCR5 | |
| SCHEMBL3284141 | 0.79 | CCR5 (0.42) | HCRTR1HCRTR2CCR5KCNK3KCNK9 | |
| SCHEMBL4693059 | 0.79 | CCR5 (0.37) | ALDH1A1CCR5KCNK3KCNK9 | |
| SCHEMBL4694466 | 0.78 | RIPK2 (0.50) | ALDH1A1 |
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 |