Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 15/20 | 0.43 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.34 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.34 |
| ▸ | F2R | P25116 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4696511 | 0.88 | CCR5 (0.40) | CCR5MAPK1 | |
| SCHEMBL4694830 | 0.86 | CCR5 (0.41) | CCR5ALDH1A1MAPK1 | |
| SCHEMBL4696469 | 0.86 | CCR5 (0.41) | CCR5MAPK1KMT2A | |
| SCHEMBL4694831 | 0.86 | CCR5 (0.41) | CCR5ALDH1A1MAPK1 | |
| SCHEMBL4695320 | 0.85 | CCR5 (0.41) | CCR5KMT2A | |
| SCHEMBL4696921 | 0.84 | CCR5 (0.47) | CCR5 | |
| SCHEMBL4696815 | 0.83 | CCR5 (0.40) | CCR5MAPK1 | |
| SCHEMBL4695429 | 0.80 | CCR5 (0.46) | CCR5 | |
| SCHEMBL4694955 | 0.79 | CCR5 (0.38) | CCR5MAPK1KMT2A | |
| SCHEMBL4694441 | 0.78 | CCR5 (0.67) | 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 1 patent. 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 | disclosed |