Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 3/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.39 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL4694455 | 0.89 | CHRNB2 (0.44) | SMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL4691301 | 0.87 | HCRTR1 (0.44) | HCRTR2HCRTR1 | |
| SCHEMBL4696365 | 0.86 | GRM5 (0.38) | ALDH1A1HCRTR2HCRTR1GRIN2B | |
| SCHEMBL3284141 | 0.83 | CCR5 (0.42) | HCRTR2HCRTR1 | |
| SCHEMBL4691673 | 0.82 | HCRTR1 (0.38) | HCRTR2HCRTR1 | |
| SCHEMBL4692750 | 0.81 | ALDH1A1 (0.44) | USP2SMN1; SMN2ALDH1A1HCRTR1CYP2D6 | |
| SCHEMBL4690222 | 0.81 | CHRNA4 (0.46) | ALDH1A1HCRTR2HCRTR1 | |
| SCHEMBL4691802 | 0.81 | CCR5 (0.48) | SMN1; SMN2ALDH1A1HCRTR2HCRTR1HPGD | |
| SCHEMBL4689903 | 0.81 | P2RX7 (0.41) | CA12CA1CA2CA7CA9 | |
| SCHEMBL4690512 | 0.80 | ALDH1A1 (0.43) | ALDH1A1HCRTR2HCRTR1GRIN2B |
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 |