Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 10/20 | 0.43 |
| ▸ | HCRTR1 | O43613 | 7/20 | 0.38 |
| ▸ | HCRTR2 | O43614 | 7/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CCL5 | P13501 | 2/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3283294 | 0.88 | HCRTR1 (0.45) | CCR5HCRTR1HCRTR2KCNH2 | |
| SCHEMBL3282223 | 0.84 | CCR5 (0.43) | CCR5HCRTR1HCRTR2CHRM2CCL5 | |
| SCHEMBL4694036 | 0.84 | HCRTR1 (0.39) | HCRTR1HCRTR2PDE4B | |
| SCHEMBL4692311 | 0.79 | LMNA (0.47) | HCRTR1HCRTR2 | |
| SCHEMBL3283985 | 0.78 | HCRTR1 (0.45) | CCR5HCRTR1HCRTR2CHRM2KCNH2 | |
| SCHEMBL4693623 | 0.78 | CCR5 (0.43) | CCR5HCRTR1HCRTR2CHRM2CCL5 | |
| SCHEMBL3283573 | 0.77 | CCR5 (0.40) | CCR5HCRTR1HCRTR2CCL5PDE4B | |
| SCHEMBL4694327 | 0.77 | HCRTR1 (0.48) | HCRTR1HCRTR2 | |
| SCHEMBL5265890 | 0.76 | HCRTR1 (0.47) | CCR5HCRTR1HCRTR2KCNH2 | |
| SCHEMBL4697501 | 0.76 | P2RX7 (0.45) | — |
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 |