Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 4/20 | 0.40 |
| ▸ | HCRTR2 | O43614 | 4/20 | 0.40 |
| ▸ | CCR5 | P51681 | 9/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CCL5 | P13501 | 9/20 | 0.37 |
| ▸ | TNF | P01375 | 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 | |
|---|---|---|---|---|
| SCHEMBL4696341 | 0.92 | HCRTR1 (0.37) | HCRTR1HCRTR2CCR5CHRM2CCL5 | |
| SCHEMBL3283594 | 0.86 | CCL5 (0.43) | CCR5CCL5 | |
| SCHEMBL3281863 | 0.85 | HCRTR1 (0.48) | HCRTR1HCRTR2CCR5TNF | |
| SCHEMBL4689556 | 0.84 | LMNA (0.50) | HCRTR1HCRTR2 | |
| SCHEMBL4695130 | 0.83 | KMT2A (0.43) | HCRTR1HCRTR2CCR5 | |
| SCHEMBL4693079 | 0.83 | HCRTR1 (0.38) | HCRTR1HCRTR2CCR5CCL5TNF | |
| SCHEMBL4694334 | 0.83 | HCRTR1 (0.43) | HCRTR1HCRTR2CCR5CCL5TNF | |
| SCHEMBL4690403 | 0.83 | HCRTR1 (0.39) | HCRTR1HCRTR2CCR5TNF | |
| SCHEMBL3282223 | 0.82 | CCR5 (0.43) | HCRTR1HCRTR2CCR5CHRM2CCL5 | |
| SCHEMBL4694788 | 0.82 | HCRTR1 (0.45) | HCRTR1HCRTR2CCR5TNF |
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 |