Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.44 |
| ▸ | DAO | P14920 | 2/20 | 0.43 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.42 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | AGXT | P21549 | 2/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3233609 | 0.86 | TAAR1 (0.47) | TAAR1ALDH1A1ESR1SLC6A3DAO | |
| SCHEMBL3371633 | 0.80 | TAAR1 (0.74) | TAAR1ALDH1A1SLC6A3DAOSLC6A4 | |
| SCHEMBL16191093 | 0.79 | TAAR1 (0.57) | TAAR1ALDH1A1SLC6A3DAOMAOB | |
| SCHEMBL5169427 | 0.79 | TAAR1 (0.57) | TAAR1SLC6A3DAOMAOBSLC6A4 | |
| SCHEMBL8591746 | 0.78 | TAAR1 (0.65) | TAAR1ALDH1A1SLC6A3DAOMAOB | |
| SCHEMBL22857553 | 0.77 | TAAR1 (0.59) | TAAR1SLC6A3DAOMAOBSLC6A4 | |
| SCHEMBL28812860 | 0.77 | TAAR1 (0.70) | TAAR1SLC6A3DAOMAOBSLC6A4 | |
| SCHEMBL3368902 | 0.76 | TAAR1 (0.68) | TAAR1MAOBIDO1AGXTMAOA | |
| SCHEMBL27858711 | 0.76 | TAAR1 (0.57) | TAAR1SLC6A3DAOMAOBSLC6A4 | |
| SCHEMBL27891098 | 0.76 | TAAR1 (0.57) | TAAR1SLC6A3DAOMAOBSLC6A4 |
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-1109799-A1 | 4,5-DIARYL-3(2H)-FURANONE DERIVATIVES AS CYCLOOXYGENASE-2 INHIBITORS | PACIFIC CORPORATION (KR) | 2001-06-27 | — | — | EP | disclosed |
| WO-2000061571-A1 | 4,5-DIARYL-3(2H)-FURANONE DERIVATIVES AS CYCLOOXYGENASE-2 INHIBITORS | PACIFIC CORPORATION (KR) | 2000-10-19 | — | — | WO | disclosed |