Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 6/20 | 0.48 |
| ▸ | HCRTR2 | O43614 | 6/20 | 0.48 |
| ▸ | TNF | P01375 | 2/20 | 0.40 |
| ▸ | PDE2A | O00408 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | MGLL | Q99685 | 1/20 | 0.34 |
| ▸ | RORC | P51449 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 2/20 | 0.33 |
| ▸ | GBA1 | P04062 | 1/20 | 0.33 |
| ▸ | CCL5 | P13501 | 1/20 | 0.33 |
| ▸ | CCR5 | P51681 | 1/20 | 0.33 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.33 |
| ▸ | KCNK9 | Q9NPC2 | 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 | |
|---|---|---|---|---|
| SCHEMBL4692886 | 0.89 | ALDH1A1 (0.42) | HCRTR1HCRTR2TNFCYP2C9CYP2C19 | |
| SCHEMBL4694224 | 0.86 | TNF (0.39) | HCRTR1HCRTR2TNFMGLLGBA1 | |
| SCHEMBL4693484 | 0.86 | HCRTR1 (0.48) | HCRTR1HCRTR2TNFGBA1CCR5 | |
| SCHEMBL4691904 | 0.86 | HCRTR1 (0.46) | HCRTR1HCRTR2TNFKCNK3KCNK9 | |
| SCHEMBL4691868 | 0.85 | HCRTR1 (0.47) | HCRTR1HCRTR2TNFGBA1CCR5 | |
| SCHEMBL4694354 | 0.85 | P2RX7 (0.44) | HCRTR1HCRTR2TNF | |
| SCHEMBL4690634 | 0.85 | TNF (0.38) | HCRTR1HCRTR2TNFGBA1CCR5 | |
| SCHEMBL4691405 | 0.85 | HCRTR1 (0.48) | HCRTR1HCRTR2TNFCYP2C9CYP2C19 | |
| SCHEMBL4694616 | 0.85 | TNF (0.38) | HCRTR1HCRTR2TNFGBA1CCR5 | |
| SCHEMBL4696301 | 0.84 | LMNA (0.42) | HCRTR1HCRTR2TNFSLC9A1GBA1 |
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 |