Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 2/20 | 0.47 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | CCR3 | P51677 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | CCR5 | P51681 | 4/20 | 0.35 |
| ▸ | PDE2A | O00408 | 1/20 | 0.35 |
| ▸ | CCL5 | P13501 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | CTSS | P25774 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4694325 | 0.87 | HCRTR1 (0.48) | HCRTR1HCRTR2MAPTALDH1A1GAA | |
| SCHEMBL4693911 | 0.84 | HCRTR1 (0.48) | HCRTR1HCRTR2MAPTALDH1A1GAA | |
| SCHEMBL3283296 | 0.83 | CCR5 (0.48) | HCRTR1HCRTR2MAPTALDH1A1GAA | |
| SCHEMBL4697502 | 0.82 | P2RX7 (0.48) | — | |
| SCHEMBL4693905 | 0.81 | HCRTR1 (0.48) | HCRTR1HCRTR2MAPTALDH1A1GAA | |
| SCHEMBL4694037 | 0.79 | MALT1 (0.42) | HCRTR1HCRTR2MAPTALDH1A1GAA | |
| SCHEMBL4690649 | 0.78 | CCR5 (0.47) | MAPTHTTCCR5CCL5 | |
| SCHEMBL4692314 | 0.77 | LMNA (0.45) | HCRTR1HCRTR2MAPTSMN1; SMN2HTT | |
| SCHEMBL13359815 | 0.74 | CCR5 (0.50) | HCRTR1HCRTR2CCR5 | |
| SCHEMBL3283988 | 0.74 | CCR5 (0.48) | HCRTR1HCRTR2MAPTALDH1A1GAA |
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 | claimed |