Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17568791 | 0.87 | ABCB11 (0.37) | SMN1; SMN2ALDH1A1GAAL3MBTL1 | |
| SCHEMBL17568804 | 0.86 | SMN1; SMN2 (0.33) | SMN1; SMN2ALDH1A1GAAL3MBTL1 | |
| SCHEMBL17568763 | 0.83 | SMN1; SMN2 (0.36) | SMN1; SMN2ALDH1A1GAAL3MBTL1 | |
| SCHEMBL7515928 | 0.83 | SMN1; SMN2 (0.36) | SMN1; SMN2ALDH1A1GAAL3MBTL1 | |
| SCHEMBL7526159 | 0.82 | CYP4F2 (0.34) | SMN1; SMN2ALDH1A1GAAL3MBTL1 | |
| SCHEMBL7521109 | 0.82 | FEN1 (0.38) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL7509910 | 0.81 | ALDH1A1 (0.36) | SMN1; SMN2ALDH1A1GAAL3MBTL1 | |
| SCHEMBL7524653 | 0.81 | SMN1; SMN2 (0.34) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL13475733 | 0.81 | ALDH1A1 (0.33) | SMN1; SMN2ALDH1A1GAAL3MBTL1 | |
| SCHEMBL7517782 | 0.80 | BACE1 (0.40) | SMN1; SMN2ALDH1A1L3MBTL1 |
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-2153832-B1 | HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS | MERCK SHARP & DOHME (US) | 2016-03-09 | — | — | EP | disclosed |