Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY12 | Q9H244 | 18/20 | 0.73 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.73 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.73 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.63 |
| ▸ | DRD3 | P35462 | 1/20 | 0.63 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL4988395 | 0.91 | P2RY12 (0.86) | P2RY12CYP2C9CYP3A4CHRM2DRD3 | |
| SCHEMBL4872525 | 0.85 | P2RY12 (0.80) | P2RY12CYP2C9CYP3A4CHRM2DRD3 | |
| SCHEMBL3590271 | 0.85 | P2RY12 (0.84) | P2RY12CYP2C9CYP3A4CHRM2DRD3 | |
| SCHEMBL4872521 | 0.85 | P2RY12 (0.81) | P2RY12CYP2C9CYP3A4CHRM2DRD3 | |
| SCHEMBL4739454 | 0.84 | P2RY12 (0.71) | P2RY12CYP2C9CYP3A4CHRM2DRD3 | |
| SCHEMBL4740602 | 0.84 | P2RY12 (0.71) | P2RY12CYP2C9CYP3A4CHRM2DRD3 | |
| SCHEMBL4880173 | 0.84 | P2RY12 (0.85) | P2RY12CYP2C9CYP3A4CHRM2DRD3 | |
| SCHEMBL4880773 | 0.84 | P2RY12 (1.00) | P2RY12CYP2C9CYP3A4CHRM2DRD3 | |
| SCHEMBL3231186 | 0.84 | P2RY12 (0.88) | P2RY12CYP2C9CYP3A4CHRM2DRD3 | |
| SCHEMBL3227699 | 0.84 | P2RY12 (0.86) | P2RY12CYP2C9CYP3A4CHRM2DRD3 |
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-2008085118-A1 | PYRIDINE COMPOUNDS AND THEIR USE AS P2Y12 ANTAGONISTS. | ASTRAZENECA AB (SE) | 2008-07-17 | — | — | WO | disclosed |