Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR2 | O43614 | 13/20 | 0.40 |
| ▸ | HCRTR1 | O43613 | 12/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | TNF | P01375 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4695901 | 0.93 | HCRTR2 (0.47) | HCRTR2HCRTR1HTT | |
| SCHEMBL4690927 | 0.91 | HCRTR1 (0.49) | HCRTR2HCRTR1ALDH1A1LMNAGFER | |
| SCHEMBL4694350 | 0.91 | KCNK3 (0.42) | HCRTR2HCRTR1ALDH1A1LMNAHTT | |
| SCHEMBL4691405 | 0.90 | HCRTR1 (0.48) | HCRTR2HCRTR1ALDH1A1HTTKDM4E | |
| SCHEMBL4690309 | 0.88 | HCRTR1 (0.38) | HCRTR2HCRTR1ALDH1A1LMNATNF | |
| SCHEMBL4689519 | 0.88 | ALDH1A1 (0.47) | HCRTR2HCRTR1ALDH1A1LMNATNF | |
| SCHEMBL4693952 | 0.87 | HCRTR1 (0.50) | HCRTR2HCRTR1TNFPDE4APDE4B | |
| SCHEMBL4694424 | 0.86 | HCRTR1 (0.37) | HCRTR2HCRTR1TNFPDE4APDE4B | |
| SCHEMBL4692329 | 0.86 | CCR5 (0.44) | HCRTR2HCRTR1ALDH1A1LMNATNF | |
| SCHEMBL4692627 | 0.85 | HCRTR1 (0.50) | HCRTR2HCRTR1ALDH1A1LMNAHTT |
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 3 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-A2 | OCTAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES AN THEIR USE AS ANTIVIRAL AGENTS | F.HOFFMANN-LA ROCHE AG (CH) | 2007-03-14 | — | — | EP | claimed |
| WO-2005121145-A2 | OCTAHYDRO-PYRROLO[3,4-C] DERIVATIVES AND THEIR USE AS ANTIVIRAL COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2005-12-22 | — | — | WO | claimed |