Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.46 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 2/20 | 0.44 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA7 | P43166 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | PDE1A | P54750 | 1/20 | 0.42 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.42 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.42 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7379340 | 0.95 | CYP3A4 (0.51) | CYP3A4SMN1; SMN2TDP1ALDH1A1HPGD | |
| SCHEMBL11355720 | 0.90 | CYP3A4 (0.47) | CYP3A4SMN1; SMN2TDP1ALDH1A1HPGD | |
| SCHEMBL844688 | 0.89 | CYP3A4 (0.47) | CYP3A4SMN1; SMN2TDP1ALDH1A1HPGD | |
| SCHEMBL28756311 | 0.88 | CYP3A4 (0.51) | CYP3A4SMN1; SMN2TDP1ALDH1A1HPGD | |
| SCHEMBL11355495 | 0.88 | CYP3A4 (0.45) | CYP3A4SMN1; SMN2TDP1ALDH1A1HPGD | |
| SCHEMBL11378236 | 0.84 | CYP3A4 (0.47) | CYP3A4SMN1; SMN2TDP1ALDH1A1HPGD | |
| SCHEMBL844533 | 0.82 | CYP3A4 (0.49) | CYP3A4SMN1; SMN2TDP1ALDH1A1HPGD | |
| SCHEMBL3030086 | 0.82 | CYP3A4 (0.47) | CYP3A4SMN1; SMN2TDP1ALDH1A1HPGD | |
| SCHEMBL29927238 | 0.82 | CYP3A4 (0.47) | CYP3A4SMN1; SMN2TDP1ALDH1A1HPGD | |
| SCHEMBL12552815 | 0.81 | CYP3A4 (0.51) | CYP3A4SMN1; SMN2TDP1ALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-100579968-C | Quinazolinone derivatives and their use as CB agonists | NOVARTIS AG | 2010-01-13 | — | — | CN | disclosed |
| CN-1628104-A | Quinazolinone derivatives and their use as CB agonists | NOVARTIS AG (CH) | 2005-06-15 | — | — | CN | disclosed |
| EP-1472234-A1 | QUINAZOLINONE DERIVATIVES AND THEIR USE AS CB AGONISTS | Novartis AG (CH) | 2004-11-03 | — | — | EP | disclosed |
| WO-2003066603-A1 | QUINAZOLINONE DERIVATIVES AND THEIR USE AS CB AGONISTS | NOVARTIS AG (CH) | 2003-08-14 | — | — | WO | disclosed |