Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 9/20 | 0.42 |
| ▸ | HCRTR2 | O43614 | 9/20 | 0.42 |
| ▸ | CBX7 | O95931 | 4/20 | 0.36 |
| ▸ | TNF | P01375 | 2/20 | 0.36 |
| ▸ | GBA1 | P04062 | 1/20 | 0.35 |
| ▸ | PDE4A | P27815 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CCR5 | P51681 | 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 | |
|---|---|---|---|---|
| SCHEMBL4692627 | 0.94 | HCRTR1 (0.50) | HCRTR1HCRTR2CBX7NPC1RAB9A | |
| SCHEMBL4693952 | 0.90 | HCRTR1 (0.50) | HCRTR1HCRTR2TNFPDE4APDE4B | |
| SCHEMBL4691868 | 0.90 | HCRTR1 (0.47) | HCRTR1HCRTR2TNFGBA1MAPT | |
| SCHEMBL4692886 | 0.90 | ALDH1A1 (0.42) | HCRTR1HCRTR2TNFGBA1MAPT | |
| SCHEMBL4691405 | 0.89 | HCRTR1 (0.48) | HCRTR1HCRTR2TNFPDE4APDE4B | |
| SCHEMBL4694354 | 0.88 | P2RX7 (0.44) | HCRTR1HCRTR2TNF | |
| SCHEMBL3281863 | 0.87 | HCRTR1 (0.48) | HCRTR1HCRTR2TNFCCR5 | |
| SCHEMBL4693896 | 0.86 | HCRTR1 (0.47) | HCRTR1HCRTR2TNFPDE4APDE4B | |
| SCHEMBL4693139 | 0.86 | HCRTR1 (0.45) | HCRTR1HCRTR2NPC1MAPT | |
| SCHEMBL4695647 | 0.86 | HCRTR1 (0.48) | HCRTR1HCRTR2TNF |
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 4 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 |
| EP-1761542-B1 | OCTAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES AN THEIR USE AS ANTIVIRAL AGENTS | HOFFMANN LA ROCHE (CH) | 2008-01-02 | — | — | EP | disclosed |