Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 9/20 | 0.46 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | NCF1 | P14598 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | PRKDC | P78527 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 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 | |
|---|---|---|---|---|
| SCHEMBL4468937 | 0.76 | CNR1 (0.69) | CNR1HSD11B1 | |
| SCHEMBL9142516 | 0.72 | CNR1 (0.36) | CNR1 | |
| SCHEMBL9141020 | 0.69 | CNR1 (0.36) | CNR1ALDH1A1KDM4E | |
| SCHEMBL4466643 | 0.69 | CNR1 (0.44) | CNR1ALDH1A1KDM4EHSD11B1 | |
| SCHEMBL4465137 | 0.68 | CNR1 (0.69) | CNR1GAA | |
| SCHEMBL4463290 | 0.67 | CNR1 (0.54) | CNR1ALDH1A1MAPTKDM4EL3MBTL1 | |
| SCHEMBL4465770 | 0.66 | CNR1 (0.40) | CNR1 | |
| Hydrochloric Acid SCHEMBL9142776 | 0.65 | IDO1 (0.41) | — | |
| SCHEMBL20140426 | 0.63 | HTR6 (0.43) | KEAP1ALDH1A1GAAHTTMAPK1 | |
| SCHEMBL2316968 | 0.63 | ALDH1A1 (0.35) | CNR1ALDH1A1GAAHTTMAPK1 |
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-1532132-A1 | NOVEL BENZODIOXOLES | F.HOFFMANN-LA ROCHE AG (CH) | 2005-05-25 | — | — | EP | disclosed |
| WO-2004013120-A1 | NOVEL BENZODIOXOLES | F. HOFFMANN-LA ROCHE AG (CH) | 2004-02-12 | — | — | WO | disclosed |