Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 11/20 | 0.41 |
| ▸ | HCRTR2 | O43614 | 11/20 | 0.41 |
| ▸ | KCNK3 | O14649 | 2/20 | 0.38 |
| ▸ | KCNK9 | Q9NPC2 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CCR5 | P51681 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4695464 | 0.88 | HCRTR1 (0.44) | HCRTR1HCRTR2KCNK3KCNK9CCR5 | |
| SCHEMBL4691895 | 0.88 | HCRTR1 (0.33) | HCRTR1HCRTR2CCR5 | |
| SCHEMBL4694116 | 0.86 | HCRTR2 (0.38) | HCRTR1HCRTR2CCR5 | |
| SCHEMBL4695826 | 0.85 | HCRTR1 (0.47) | HCRTR1HCRTR2KMT2A | |
| SCHEMBL4690142 | 0.83 | MAPK14 (0.41) | HCRTR1HCRTR2MAPK14 | |
| SCHEMBL4690995 | 0.83 | LMNA (0.38) | HCRTR1HCRTR2POLBKMT2ALMNA | |
| SCHEMBL4692504 | 0.82 | HCRTR1 (0.44) | HCRTR1HCRTR2GAAKMT2ALMNA | |
| SCHEMBL4690347 | 0.82 | HCRTR2 (0.42) | HCRTR1HCRTR2CCR5 | |
| SCHEMBL4693757 | 0.82 | LMNA (0.39) | HCRTR1HCRTR2LMNACCR5 | |
| SCHEMBL4694094 | 0.81 | CHRNB2 (0.44) | GAACCR5 |
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 |