Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.97 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.97 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.97 |
| ▸ | HPGD | P15428 | 1/20 | 0.97 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.97 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | GFER | P55789 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | MITF | O75030 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL15684679 | 0.98 | CYP1A2 (1.00) | CYP1A2CYP2C19CYP2C9HPGDMAPK1 | |
| SCHEMBL13315336 | 0.89 | CYP1A2 (0.82) | CYP1A2CYP2C19CYP2C9HPGDMAPK1 | |
| SCHEMBL6203010 | 0.89 | CYP2C19 (0.82) | CYP1A2CYP2C19CYP2C9HPGDMAPK1 | |
| SCHEMBL6318911 | 0.86 | CYP2C19 (0.74) | CYP1A2CYP2C19CYP2C9HPGDMAPK1 | |
| SCHEMBL7592799 | 0.85 | CYP1A2 (0.71) | CYP1A2CYP2C19CYP2C9HPGDMAPK1 | |
| SCHEMBL14010678 | 0.84 | CYP1A2 (0.74) | CYP1A2CYP2C19CYP2C9HPGDMAPK1 | |
| SCHEMBL4855890 | 0.83 | CYP1A2 (0.74) | CYP1A2CYP2C19CYP2C9HPGDMAPK1 | |
| SCHEMBL6266551 | 0.81 | CYP1A2 (0.70) | CYP1A2CYP2C19CYP2C9HPGDMAPK1 | |
| SCHEMBL12123601 | 0.80 | CYP1A2 (0.68) | CYP1A2CYP2C19CYP2C9HPGDMAPK1 | |
| SCHEMBL7619614 | 0.80 | HPGD (0.69) | CYP1A2CYP2C19CYP2C9HPGDMAPK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050272036-A1 | Ketones | ASTRAZENECA AB (SE) | 2005-12-08 | — | — | US | disclosed |
| EP-1549600-A1 | KETONES | AstraZeneca AB (SE) | 2005-07-06 | — | — | EP | disclosed |
| WO-2004011410-A1 | CHEMICAL COMPOUNDS | ASTRAZENECA AB (SE) | 2004-02-05 | — | — | WO | disclosed |