Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 16/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 16/20 | 0.37 |
| ▸ | CCR5 | P51681 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4694116 | 0.82 | HCRTR2 (0.38) | HCRTR1HCRTR2CCR5 | |
| SCHEMBL4691531 | 0.82 | HCRTR1 (0.41) | HCRTR1HCRTR2CCR5 | |
| SCHEMBL4690347 | 0.82 | HCRTR2 (0.42) | HCRTR1HCRTR2CCR5 | |
| SCHEMBL4690325 | 0.80 | CCR5 (0.40) | CCR5 | |
| SCHEMBL4693574 | 0.80 | CCR5 (0.40) | HCRTR1HCRTR2CCR5 | |
| SCHEMBL4691447 | 0.79 | CCR5 (0.41) | CCR5 | |
| SCHEMBL4693120 | 0.79 | CCR5 (0.39) | HCRTR1HCRTR2CCR5 | |
| SCHEMBL4694094 | 0.79 | CHRNB2 (0.44) | CCR5 | |
| SCHEMBL4696489 | 0.78 | CCR5 (0.42) | HCRTR1HCRTR2CCR5 | |
| SCHEMBL4691191 | 0.78 | HCRTR1 (0.40) | HCRTR1HCRTR2 |
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 |