Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 12/20 | 0.41 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.40 |
| ▸ | IAPP | P10997 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.34 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GABRP | O00591 | 1/20 | 0.33 |
| ▸ | GABRD | O14764 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 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 | 0.84 | S1PR1 (0.41) | S1PR1C5AR1CYP2D6CYP2C9SLC6A2 | |
| SCHEMBL6514263 | 0.84 | C5AR1 (0.44) | S1PR1C5AR1CYP2D6CYP2C9 | |
| SCHEMBL1327715 | 0.79 | S1PR1 (0.39) | S1PR1C5AR1 | |
| SCHEMBL2068766 | 0.78 | C5AR1 (0.39) | S1PR1C5AR1CYP2D6CYP2C9LMNA | |
| SCHEMBL2140675 | 0.76 | C5AR1 (0.36) | S1PR1C5AR1CYP2D6ALDH1A1SLC6A2 | |
| SCHEMBL1328622 | 0.76 | C5AR1 (0.41) | S1PR1C5AR1CYP2D6CYP2C9ALDH1A1 | |
| SCHEMBL1327704 | 0.75 | C5AR1 (0.38) | S1PR1C5AR1CYP2D6CYP2C9MEN1 | |
| SCHEMBL1328085 | 0.74 | C5AR1 (0.36) | S1PR1C5AR1CYP2D6ALDH1A1MEN1 | |
| SCHEMBL1328940 | 0.74 | NPSR1 (0.43) | C5AR1FFAR4ALDH1A1MEN1MAPT | |
| SCHEMBL1404966 | 0.72 | ALDH1A1 (0.51) | IAPPFFAR4ALDH1A1LMNATAS1R3 |
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 |