Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 7/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.42 |
| ▸ | NPC1 | O15118 | 4/20 | 0.42 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.42 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | CCR5 | P51681 | 5/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | HTR7 | P34969 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL4692628 | 0.94 | HCRTR1 (0.50) | SMN1; SMN2NPC1RAB9AHCRTR1HCRTR2 | |
| SCHEMBL4694080 | 0.93 | HCRTR1 (0.40) | MAPTSMN1; SMN2NPC1RAB9ANFKB1 | |
| SCHEMBL4692676 | 0.90 | P2RX7 (0.45) | MAPTSMN1; SMN2RAB9AHCRTR1HCRTR2 | |
| SCHEMBL4691872 | 0.90 | HCRTR1 (0.47) | MAPTSMN1; SMN2RAB9AHCRTR1HCRTR2 | |
| SCHEMBL4692889 | 0.90 | MAPT (0.45) | MAPTSMN1; SMN2HCRTR1HCRTR2ALDH1A1 | |
| SCHEMBL4693956 | 0.90 | HCRTR1 (0.49) | MAPTSMN1; SMN2NPC1RAB9AHCRTR1 | |
| SCHEMBL4691406 | 0.89 | HCRTR1 (0.48) | MAPTNPC1HCRTR1HCRTR2ALDH1A1 | |
| SCHEMBL4691764 | 0.89 | CCR5 (0.42) | MAPTSMN1; SMN2RAB9AHCRTR1HCRTR2 | |
| SCHEMBL3284097 | 0.88 | CCR5 (0.41) | MAPTSMN1; SMN2RAB9AHCRTR1HCRTR2 | |
| SCHEMBL4694356 | 0.88 | P2RX7 (0.43) | MAPTSMN1; SMN2ALDH1A1CCR5KDM4E |
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 4 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-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 |
| EP-1761542-B1 | OCTAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES AN THEIR USE AS ANTIVIRAL AGENTS | HOFFMANN LA ROCHE (CH) | 2008-01-02 | — | — | EP | disclosed |