Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8802789 | 0.90 | TP53 (0.37) | NPC1ALDH1A1HPGDRAB9A | |
| SCHEMBL6974419 | 0.87 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL8800746 | 0.86 | KCNH2 (0.35) | ALDH1A1 | |
| SCHEMBL6968462 | 0.85 | — | — | |
| SCHEMBL7084666 | 0.84 | SLC18A3 (0.38) | ALDH1A1HPGD | |
| SCHEMBL8800407 | 0.83 | MEN1 (0.33) | ALDH1A1HPGD | |
| SCHEMBL8347016 | 0.83 | HSP90B1 (0.33) | NPC1ALDH1A1HPGDRAB9A | |
| SCHEMBL6965389 | 0.82 | NPC1 (0.31) | NPC1ALDH1A1HPGDRAB9A | |
| SCHEMBL6974146 | 0.82 | ALDH1A1 (0.36) | ALDH1A1HPGD | |
| SCHEMBL8800250 | 0.81 | SLC6A9 (0.34) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0786455-A1 | IMIDAZOLE DERIVATIVE | SHIONOGI & CO., LTD. (JP) | 1997-07-30 | — | — | EP | disclosed |