Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | RORC | P51449 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.38 |
| ▸ | CCR4 | P51679 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5235733 | 0.92 | SIGMAR1 (0.44) | ALDH1A1SIGMAR1L3MBTL1KMT2A | |
| SCHEMBL5237894 | 0.92 | SIGMAR1 (0.46) | ALDH1A1SIGMAR1KMT2A | |
| SCHEMBL5237863 | 0.88 | SIGMAR1 (0.41) | ALDH1A1SIGMAR1L3MBTL1 | |
| SCHEMBL5238559 | 0.86 | SIGMAR1 (0.40) | ALDH1A1SIGMAR1L3MBTL1KMT2A | |
| SCHEMBL5234646 | 0.85 | HCRTR1 (0.38) | SIGMAR1POLB | |
| SCHEMBL5236854 | 0.84 | HPGD (0.43) | ALDH1A1SIGMAR1GAAKMT2A | |
| SCHEMBL5238021 | 0.84 | HPGD (0.41) | ALDH1A1SIGMAR1POLBKMT2A | |
| SCHEMBL5233648 | 0.84 | HCRTR1 (0.42) | ALDH1A1SIGMAR1POLBLIPG | |
| SCHEMBL5236149 | 0.84 | MAPK1 (0.40) | ALDH1A1SIGMAR1L3MBTL1MAPK1GAA | |
| SCHEMBL5237363 | 0.84 | HCRTR1 (0.39) | ALDH1A1SIGMAR1KMT2A |
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-A2 | OCTAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES AN THEIR USE AS ANTIVIRAL AGENTS | F.HOFFMANN-LA ROCHE AG (CH) | 2007-03-14 | — | — | EP | claimed |
| WO-2005121145-A2 | OCTAHYDRO-PYRROLO[3,4-C] DERIVATIVES AND THEIR USE AS ANTIVIRAL COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2005-12-22 | — | — | WO | claimed |