Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.77 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.77 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.77 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.77 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.77 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.71 |
| ▸ | EPAS1 | Q99814 | 2/20 | 0.64 |
| ▸ | KIF11 | P52732 | 1/20 | 0.56 |
| ▸ | FBP1 | P09467 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 4/20 | 0.53 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | MPO | P05164 | 1/20 | 0.52 |
| ▸ | ARNT | P27540 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL2646781 | 0.95 | AKR1B1 (0.70) | AKR1B1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL13811262 | 0.91 | MAPK1 (0.75) | AKR1B1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL11468688 | 0.91 | AKR1B1 (0.72) | AKR1B1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL8559459 | 0.91 | AKR1B1 (0.69) | AKR1B1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL1668253 | 0.91 | AKR1B1 (0.69) | AKR1B1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL2641949 | 0.91 | AKR1B1 (0.69) | AKR1B1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL8559703 | 0.89 | AKR1B1 (0.70) | AKR1B1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL11392520 | 0.88 | MAPK1 (0.84) | AKR1B1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL2493312 | 0.87 | AKR1B1 (0.65) | AKR1B1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL10855276 | 0.87 | MAPK1 (0.73) | AKR1B1AKR1C4AKR1C3AKR1C2AKR1C1 |
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-0616807-B1 | Benzimidazole useful in the treatment of central nervous system disorders | NEUROSEARCH AS (DK) | 1998-07-08 | — | — | EP | disclosed |