Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H3 | Q13133 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | SLC1A5 | Q15758 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.40 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | CTSG | P08311 | 1/20 | 0.39 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7607627 | 0.88 | NR1H3 (0.44) | NR1H3ALDH1A1MAPTSLC1A5TSHR | |
| SCHEMBL7607631 | 0.88 | NR1H3 (0.44) | NR1H3ALDH1A1MAPTSLC1A5TSHR | |
| SCHEMBL7605883 | 0.85 | ALDH1A1 (0.45) | NR1H3ALDH1A1MAPTSLC1A5NPC1 | |
| SCHEMBL11748916 | 0.84 | ELANE (0.40) | ALDH1A1MAPTPOLBMEN1KMT2A | |
| SCHEMBL7605016 | 0.84 | MAPT (0.43) | NR1H3ALDH1A1MAPTNPC1POLB | |
| SCHEMBL6320449 | 0.83 | NR1H3 (0.47) | NR1H3ALDH1A1MAPTSLC1A5TSHR | |
| SCHEMBL6320445 | 0.83 | NR1H3 (0.47) | NR1H3ALDH1A1MAPTSLC1A5TSHR | |
| SCHEMBL7606604 | 0.82 | ALDH1A1 (0.43) | ALDH1A1MAPTSLC1A5NPC1MEN1 | |
| SCHEMBL7610085 | 0.81 | HDAC3 (0.44) | NR1H3ALDH1A1MAPTNPC1MEN1 | |
| SCHEMBL7608453 | 0.81 | ALOX5 (0.40) | ALDH1A1MAPTMEN1KMT2ARAB9A |
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 |