Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | C5AR1 | P21730 | 4/20 | 0.44 |
| ▸ | S1PR1 | P21453 | 14/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.37 |
| ▸ | GCK | P35557 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6522026 | 0.89 | S1PR1 (0.41) | C5AR1S1PR1CYP2D6CYP2C9 | |
| SCHEMBL6518505 | 0.87 | C5AR1 (0.37) | C5AR1GCK | |
| SCHEMBL6513206 | 0.84 | S1PR1 (0.41) | C5AR1S1PR1CYP2D6CYP2C9 | |
| SCHEMBL2068766 | 0.78 | C5AR1 (0.39) | C5AR1S1PR1CYP2D6CYP2C9 | |
| SCHEMBL2140675 | 0.76 | C5AR1 (0.36) | C5AR1S1PR1CYP2D6 | |
| SCHEMBL6522088 | 0.76 | NPSR1 (0.36) | C5AR1 | |
| SCHEMBL6522043 | 0.76 | PPARA (0.49) | — | |
| SCHEMBL1328622 | 0.76 | C5AR1 (0.41) | C5AR1S1PR1CYP2D6CYP2C9 | |
| SCHEMBL6520800 | 0.75 | ALOX5 (0.43) | C5AR1 | |
| SCHEMBL1327704 | 0.75 | C5AR1 (0.38) | C5AR1S1PR1CYP2D6CYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1565452-A2 | 3-SUBSTITUTED-6-ARYL PYRIDINES AS LIGANDS OF C5A RECEPTORS | NEUROGEN CORPORATION (US) | 2005-08-24 | — | — | EP | disclosed |
| WO-2004043925-A2 | 3-SUBSTITUTED-6-ARYL PYRIDINED AS LIGANDS OF C5A RECEPTORS | NEUROGEN CORPORATION (US) | 2004-05-27 | — | — | WO | disclosed |