Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 18/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | SLC6A9 | P48067 | 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 | |
|---|---|---|---|---|
| SCHEMBL4691915 | 0.92 | CCR5 (0.49) | CCR5SLC6A9 | |
| SCHEMBL4690751 | 0.88 | CCR5 (0.53) | CCR5SLC6A9 | |
| SCHEMBL4694351 | 0.87 | CCR5 (0.52) | CCR5SLC6A9 | |
| SCHEMBL4694443 | 0.87 | CCR5 (0.55) | CCR5SLC6A9 | |
| SCHEMBL4695355 | 0.85 | CCR5 (0.56) | CCR5SLC6A9 | |
| SCHEMBL3283235 | 0.84 | CCR5 (0.55) | CCR5SLC6A9 | |
| SCHEMBL4693860 | 0.84 | CCR5 (0.55) | CCR5SLC6A9 | |
| SCHEMBL4689957 | 0.84 | CCR5 (0.52) | CCR5SLC6A9 | |
| SCHEMBL4690188 | 0.84 | CCR5 (0.69) | CCR5 | |
| SCHEMBL4690196 | 0.84 | CCR5 (0.69) | CCR5 |
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 |