Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.36 |
| ▸ | CNR2 | P34972 | 2/20 | 0.34 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.34 |
| ▸ | HTR6 | P50406 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | RORC | P51449 | 1/20 | 0.32 |
| ▸ | CTSL | P07711 | 3/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7608457 | 0.86 | BCHE (0.41) | GAAMAPTL3MBTL1RAB9A | |
| SCHEMBL7610616 | 0.84 | ALDH1A1 (0.43) | ALDH1A1GAAMAPTMEN1KMT2A | |
| SCHEMBL7605286 | 0.82 | MEN1 (0.39) | KDM4EALDH1A1GAAMAPTMEN1 | |
| SCHEMBL7612156 | 0.79 | NPC1 (0.44) | KDM4EGAAMEN1KMT2ANPC1 | |
| SCHEMBL7609855 | 0.79 | NPC1 (0.44) | KDM4EGAAMEN1KMT2ANPC1 | |
| SCHEMBL7608227 | 0.77 | PTGS1 (0.40) | GAAMAPTL3MBTL1RAB9A | |
| SCHEMBL7610365 | 0.74 | AOC3 (0.40) | ALDH1A1MAPTNPC1RAB9ATDP1 | |
| SCHEMBL7611109 | 0.74 | AOC3 (0.40) | ALDH1A1MAPTNPC1RAB9ATDP1 | |
| SCHEMBL7606237 | 0.73 | NPC1 (0.39) | ALDH1A1MAPTTP53L3MBTL1NPC1 | |
| SCHEMBL7606604 | 0.73 | ALDH1A1 (0.43) | ALDH1A1MAPTMEN1KMT2ATP53 |
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-1230210-A1 | AMINOALCOHOL DERIVATIVES USEFUL FOR THE TREATMENT OF GASTROINTESTINAL DISORDERS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2002-08-14 | — | — | EP | disclosed |
| WO-2001036375-A1 | AMINOALCOHOL DERIVATIVES USEFUL FOR THE TREATMENT OF GASTROINTESTINAL DISORDERS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2001-05-25 | — | — | WO | disclosed |