Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY12 | Q9H244 | 17/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | PDE4A | P27815 | 1/20 | 0.37 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.37 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL3229431 | 0.90 | P2RY12 (0.52) | P2RY12ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL3230375 | 0.81 | P2RY12 (0.62) | P2RY12ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL3231241 | 0.79 | P2RY12 (0.60) | P2RY12ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL4161320 | 0.78 | P2RY12 (0.47) | P2RY12ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL3234380 | 0.77 | P2RY12 (0.61) | P2RY12ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL3232013 | 0.73 | SMN1; SMN2 (0.42) | P2RY12ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL3326980 | 0.73 | P2RY12 (0.72) | P2RY12CYP2C9CYP3A4 | |
| SCHEMBL4165236 | 0.73 | P2RY12 (0.43) | P2RY12ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL3229240 | 0.72 | P2RY12 (0.59) | P2RY12ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL3223767 | 0.71 | P2RY12 (0.49) | P2RY12ALDH1A1KDM4EGAAMAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010005384-A1 | KETONE PYRIDINE ANALOGUES AND THEIR USE IN THE TREATMENT OF CARDIOVASCULAR DISORDERS | ASTRAZENECA AB (SE) | 2010-01-14 | — | — | WO | disclosed |