Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HCRTR1 | O43613 | 11/20 | 0.36 |
| ▸ | HCRTR2 | O43614 | 11/20 | 0.36 |
| ▸ | CCR5 | P51681 | 2/20 | 0.34 |
| ▸ | HRH2 | P25021 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.31 |
| ▸ | SLC6A1 | P30531 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | 0.86 | P2RX7 (0.41) | ALDH1A1CCR5SLC6A1 | |
| SCHEMBL4691802 | 0.84 | CCR5 (0.48) | ALDH1A1HCRTR1HCRTR2CCR5ACHE | |
| SCHEMBL4694455 | 0.81 | CHRNB2 (0.44) | ALDH1A1CCR5 | |
| SCHEMBL4694336 | 0.80 | HCRTR1 (0.36) | ALDH1A1HCRTR1HCRTR2CCR5 | |
| SCHEMBL3284141 | 0.80 | CCR5 (0.42) | HCRTR1HCRTR2CCR5SLC6A1 | |
| SCHEMBL4695295 | 0.79 | HSD17B10 (0.45) | ALDH1A1HCRTR1HCRTR2MAPT | |
| SCHEMBL4691301 | 0.78 | HCRTR1 (0.44) | HCRTR1HCRTR2CCR5 | |
| SCHEMBL4694309 | 0.78 | HCRTR1 (0.39) | HCRTR1HCRTR2 | |
| SCHEMBL4693059 | 0.77 | CCR5 (0.37) | ALDH1A1CCR5MAPK8SLC6A1 | |
| SCHEMBL4693659 | 0.77 | CHRNB2 (0.47) | ALDH1A1CCR5MAPT |
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 |