Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY12 | Q9H244 | 6/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | HPGD | P15428 | 4/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.46 |
| ▸ | CASP1 | P29466 | 3/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | CASP7 | P55210 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 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 | |
|---|---|---|---|---|
| SCHEMBL3234102 | 0.87 | ALDH1A1 (0.47) | P2RY12KDM4EALDH1A1HPGDMAPK1 | |
| SCHEMBL3329682 | 0.85 | P2RY12 (0.49) | P2RY12KDM4EALDH1A1HPGDMAPK1 | |
| SCHEMBL3329418 | 0.85 | P2RY12 (0.49) | P2RY12KDM4EALDH1A1HPGDMAPK1 | |
| SCHEMBL3328020 | 0.85 | P2RY12 (0.57) | P2RY12KDM4EALDH1A1HPGDMAPK1 | |
| SCHEMBL3232612 | 0.85 | P2RY12 (0.69) | P2RY12KDM4EALDH1A1HPGDMAPK1 | |
| SCHEMBL3229339 | 0.85 | ALDH1A1 (0.58) | P2RY12KDM4EALDH1A1MAPK1KMT2A | |
| SCHEMBL3223767 | 0.79 | P2RY12 (0.49) | P2RY12KDM4EALDH1A1HPGDMAPK1 | |
| SCHEMBL4881773 | 0.79 | KDM4E (0.72) | P2RY12KDM4EALDH1A1MAPK1GAA | |
| SCHEMBL3942186 | 0.76 | P2RY12 (0.40) | P2RY12KDM4EALDH1A1HPGDMAPK1 | |
| SCHEMBL4115190 | 0.75 | P2RY12 (0.70) | P2RY12KDM4EALDH1A1HPGDL3MBTL1 |
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 |