Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | TSPO | P30536 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 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 | |
|---|---|---|---|---|
| SCHEMBL6668965 | 0.93 | NR1H4 (0.39) | NR1H4HSP90AA1NPC1ALDH1A1HTT | |
| SCHEMBL7845789 | 0.82 | NPC1 (0.39) | HSP90AA1NPC1ALDH1A1HTTRAB9A | |
| SCHEMBL6672672 | 0.80 | NR1H4 (0.34) | NR1H4HSP90AA1NPC1MAPK14SMN1; SMN2 | |
| SCHEMBL6670849 | 0.80 | NR1H4 (0.41) | NR1H4HSP90AA1NPC1ALDH1A1HTT | |
| SCHEMBL6671405 | 0.79 | HSP90AA1 (0.40) | NR1H4HSP90AA1NPC1ALDH1A1HTT | |
| SCHEMBL6672671 | 0.79 | NR1H4 (0.40) | NR1H4HSP90AA1NPC1ALDH1A1HTT | |
| SCHEMBL7014028 | 0.78 | ALDH1A1 (0.37) | NR1H4HSP90AA1NPC1ALDH1A1HTT | |
| SCHEMBL6672237 | 0.75 | NR1H4 (0.33) | NR1H4HSP90AA1MAPK14 | |
| SCHEMBL7483549 | 0.75 | HSP90AA1 (0.44) | NR1H4HSP90AA1NPC1ALDH1A1HTT | |
| SCHEMBL7478855 | 0.74 | POLA1 (0.39) | NR1H4NPC1RAB9A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004019940-A1 | METHOD OF PREVENTING OR TREATING ATHEROSCLEROSIS OR RESTENOSIS | PHARMACIA & UPJOHN COMPANY (US) | 2004-03-11 | — | — | WO | claimed |