Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 2/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | GRIA4 | P48058 | 2/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | TDO2 | P48775 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27862778 | 0.73 | NPC1 (0.51) | CNR1NPC1ADAM17MAPTMAPK1 | |
| SCHEMBL1985442 | 0.73 | NPC1 (0.51) | CNR1NPC1ADAM17MAPTMAPK1 | |
| SCHEMBL3486501 | 0.73 | NPC1 (0.51) | CNR1NPC1ADAM17MAPTMAPK1 | |
| SCHEMBL16021896 | 0.72 | MME (0.43) | CNR1ALOX5ALDH1A1CHRNB2CHRNB4 | |
| SCHEMBL1984032 | 0.72 | ALDH1A1 (0.50) | CNR1ALDH1A1GRIA4HSP90AA1MAPT | |
| SCHEMBL17466741 | 0.72 | ALDH1A1 (0.50) | CNR1ALDH1A1GRIA4HSP90AA1MAPT | |
| SCHEMBL14928381 | 0.71 | — | — | |
| SCHEMBL17466748 | 0.70 | ALDH1A1 (0.49) | CNR1ALDH1A1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL8586940 | 0.70 | ALDH1A1 (0.43) | ALOX5ALDH1A1NPC1ADAM17HSP90AA1 | |
| SCHEMBL1983437 | 0.70 | ALDH1A1 (0.49) | CNR1ALDH1A1MAPTHPGDSMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5310941-A | Antiarrythmia agents | ORTHO PHARMACEUTICAL CORPORATION (US) | 1994-05-10 | — | — | US | disclosed |
| US-5294621-A | Thieno tetrahydropyridines useful as class III antiarrhythmic agents | ORTHO PHARMACEUTICAL CORPORATION (US) | 1994-03-15 | — | — | US | disclosed |
| US-5208252-A | Antiarrhythmia | ORTHO PHARMACEUTICAL CORPORATION (US) | 1993-05-04 | — | — | US | disclosed |