Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 2/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5235903 | 0.85 | CCR5 (0.40) | HCRTR1HCRTR2 | |
| SCHEMBL5231921 | 0.85 | P2RX7 (0.40) | ALDH1A1 | |
| SCHEMBL5232784 | 0.84 | CHRNB2 (0.43) | ALDH1A1 | |
| SCHEMBL4693311 | 0.84 | ALDH1A1 (0.41) | ALDH1A1 | |
| SCHEMBL4692746 | 0.83 | CCR5 (0.33) | HCRTR1HCRTR2 | |
| SCHEMBL4691561 | 0.81 | CHRM2 (0.36) | ALDH1A1 | |
| SCHEMBL4692727 | 0.81 | SIGMAR1 (0.40) | HCRTR1HCRTR2 | |
| SCHEMBL4692004 | 0.79 | CHRNB2 (0.34) | — | |
| SCHEMBL5233193 | 0.79 | HTT (0.42) | ALDH1A1 | |
| SCHEMBL4692752 | 0.79 | HTT (0.39) | ALDH1A1 |
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 |