Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 2/20 | 0.40 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 5/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | DRD3 | P35462 | 4/20 | 0.39 |
| ▸ | CCR5 | P51681 | 5/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.37 |
| ▸ | DRD2 | P14416 | 4/20 | 0.37 |
| ▸ | DRD4 | P21917 | 3/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4691305 | 0.93 | MAPT (0.42) | HCRTR1HCRTR2MAPTALDH1A1CCR5 | |
| SCHEMBL4692628 | 0.91 | HCRTR1 (0.50) | HCRTR1HCRTR2ALDH1A1DRD3SMN1; SMN2 | |
| SCHEMBL4692999 | 0.90 | CCR5 (0.40) | HCRTR1HCRTR2MAPTALDH1A1CCR5 | |
| SCHEMBL4693961 | 0.90 | HCRTR1 (0.46) | HCRTR1HCRTR2MAPTALDH1A1CCR5 | |
| SCHEMBL3284097 | 0.87 | CCR5 (0.41) | HCRTR1HCRTR2MAPTALDH1A1CCR5 | |
| SCHEMBL4694077 | 0.87 | DRD3 (0.43) | DRD3SIGMAR1DRD2DRD4 | |
| SCHEMBL4693956 | 0.86 | HCRTR1 (0.49) | HCRTR1HCRTR2MAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL4694783 | 0.86 | MAPT (0.46) | HCRTR1HCRTR2MAPTALDH1A1CCR5 | |
| SCHEMBL4691406 | 0.86 | HCRTR1 (0.48) | HCRTR1HCRTR2MAPTALDH1A1NPC1 | |
| SCHEMBL4691764 | 0.86 | CCR5 (0.42) | HCRTR1HCRTR2MAPTALDH1A1CCR5 |
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 |