Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 10/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.41 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 4/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4691872 | 0.95 | HCRTR1 (0.47) | CCR5ALDH1A1MAPTHCRTR1HCRTR2 | |
| SCHEMBL4695648 | 0.94 | HCRTR1 (0.48) | CCR5ALDH1A1MAPTHCRTR1HCRTR2 | |
| SCHEMBL4692218 | 0.93 | CCR5 (0.42) | CCR5ALDH1A1MAPTHCRTR1HCRTR2 | |
| SCHEMBL4694356 | 0.93 | P2RX7 (0.43) | CCR5ALDH1A1MAPTGAASMN1; SMN2 | |
| SCHEMBL4693334 | 0.93 | ALDH1A1 (0.45) | CCR5ALDH1A1MAPTGAASMN1; SMN2 | |
| SCHEMBL4692999 | 0.93 | CCR5 (0.40) | CCR5ALDH1A1MAPTHCRTR1HCRTR2 | |
| SCHEMBL4692676 | 0.91 | P2RX7 (0.45) | CCR5ALDH1A1MAPTHCRTR1HCRTR2 | |
| SCHEMBL4692889 | 0.91 | MAPT (0.45) | CCR5ALDH1A1MAPTHCRTR1HCRTR2 | |
| SCHEMBL4693956 | 0.91 | HCRTR1 (0.49) | ALDH1A1MAPTHCRTR1HCRTR2GAA | |
| SCHEMBL4694167 | 0.90 | HCRTR1 (0.48) | CCR5ALDH1A1MAPTHCRTR1HCRTR2 |
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 |