Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 1/20 | 0.66 |
| ▸ | FDPS | P14324 | 1/20 | 0.63 |
| ▸ | ALOX5 | P09917 | 5/20 | 0.59 |
| ▸ | MET | P08581 | 4/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CA12 | O43570 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.53 |
| ▸ | CA7 | P43166 | 1/20 | 0.53 |
| ▸ | CA9 | Q16790 | 1/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.53 |
| ▸ | TTR | P02766 | 1/20 | 0.52 |
| ▸ | DPP4 | P27487 | 1/20 | 0.52 |
| ▸ | ACHE | P22303 | 3/20 | 0.51 |
| ▸ | BCHE | P06276 | 2/20 | 0.51 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL6556435 | 1.00 | MAOB (0.66) | MAOBFDPSALOX5METCYP3A4 | |
| SCHEMBL8772845 | 0.86 | MAOB (0.68) | MAOBFDPSALOX5METCA1 | |
| SCHEMBL2394280 | 0.86 | ALOX5 (0.78) | MAOBFDPSALOX5METCYP3A4 | |
| SCHEMBL8772838 | 0.86 | MAOB (0.68) | MAOBFDPSALOX5METCA1 | |
| SCHEMBL5180134 | 0.86 | ALOX5 (0.78) | MAOBFDPSALOX5METCYP3A4 | |
| SCHEMBL7784424 | 0.84 | MAOB (0.72) | MAOBFDPSALOX5METCYP3A4 | |
| SCHEMBL27928903 | 0.83 | KDM4E (0.68) | ALOX5CYP3A4CA12CA1CA2 | |
| SCHEMBL6556341 | 0.83 | KDM4E (0.68) | ALOX5CYP3A4CA12CA1CA2 | |
| SCHEMBL8046251 | 0.82 | FDPS (0.84) | MAOBFDPSCA12CA1CA2 | |
| SCHEMBL31087309 | 0.82 | FDPS (0.84) | MAOBFDPSCA12CA1CA2 |
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-0958285-B1 | TRICYCLIC BENZO[e]ISOINDOLES AND BENZO[h]ISOQUINOLINES | HOFFMANN LA ROCHE (CH) | 2004-01-07 | — | — | EP | disclosed |
| US-6310208-B1 | Serotonin receptor binding benzo[e]isoindoles and benzo[h]isoquinolines | HOFFMANN-LA ROCHE INC. | 2001-10-30 | — | — | US | disclosed |
| EP-0958285-A1 | TRICYCLIC BENZO[e]ISOINDOLES AND BENZO[h]ISOQUINOLINES | F.HOFFMANN-LA ROCHE AG (CH) | 1999-11-24 | — | — | EP | disclosed |
| WO-1998030546-A1 | TRICYCLIC BENZO[e]ISOINDOLES AND BENZO[h]ISOQUINOLINES | F. HOFFMANN-LA ROCHE AG (CH) | 1998-07-16 | — | — | WO | disclosed |