Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 3/20 | 0.52 |
| ▸ | NR1H3 | Q13133 | 3/20 | 0.52 |
| ▸ | CES2 | O00748 | 1/20 | 0.45 |
| ▸ | BCHE | P06276 | 1/20 | 0.45 |
| ▸ | CES1 | P23141 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | FAAH | O00519 | 2/20 | 0.40 |
| ▸ | MGLL | Q99685 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 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 | |
|---|---|---|---|---|
| SCHEMBL6427000 | 0.92 | NR1H2 (0.60) | NR1H2NR1H3CES2BCHECES1 | |
| SCHEMBL6426845 | 0.92 | MAPT (0.50) | NR1H2NR1H3CES2BCHECES1 | |
| SCHEMBL6428883 | 0.90 | NR1H2 (0.48) | NR1H2NR1H3CES2BCHECES1 | |
| SCHEMBL6426484 | 0.89 | APAF1 (0.52) | NR1H2NR1H3BCHECES1MEN1 | |
| SCHEMBL6429547 | 0.88 | CMA1 (0.54) | NR1H2NR1H3MEN1KMT2AALDH1A1 | |
| SCHEMBL6427927 | 0.86 | MAPT (0.52) | NR1H2NR1H3MEN1KMT2AALDH1A1 | |
| SCHEMBL6427394 | 0.86 | NR1H2 (0.51) | NR1H2NR1H3CES2BCHECES1 | |
| SCHEMBL7558814 | 0.85 | CES2 (0.53) | NR1H2NR1H3CES2BCHECES1 | |
| SCHEMBL6429372 | 0.83 | SMN1; SMN2 (0.57) | KMT2ATP53ALDH1A1LMNAMAPT | |
| SCHEMBL6428041 | 0.80 | NR1H2 (0.38) | NR1H2NR1H3CES2BCHECES1 |
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-2005024755-A2 | MEDICAMENTS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS OR DIABETES | DECIPHERA PHARMACEUTICALS, LLC. (US) | 2005-03-17 | — | — | WO | disclosed |