Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MELK | Q14680 | 2/20 | 0.41 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 3/20 | 0.37 |
| ▸ | DRD4 | P21917 | 3/20 | 0.37 |
| ▸ | DRD3 | P35462 | 3/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.34 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL23968001 | 0.86 | MELK (0.51) | MELKARL3MBTL1DRD2DRD4 | |
| SCHEMBL23968020 | 0.85 | KMT2A (0.47) | MELKGPR119DRD2DRD4DRD3 | |
| SCHEMBL23968023 | 0.83 | GPR119 (0.40) | MELKGPR119DRD2DRD4DRD3 | |
| SCHEMBL23968066 | 0.81 | GPR119 (0.41) | MELKGPR119DRD2DRD4DRD3 | |
| SCHEMBL23968168 | 0.81 | MELK (0.46) | MELKARL3MBTL1DRD2DRD4 | |
| SCHEMBL23968105 | 0.81 | MELK (0.39) | MELKARL3MBTL1DRD2DRD4 | |
| SCHEMBL23968157 | 0.80 | MELK (0.40) | MELKARL3MBTL1DRD2DRD4 | |
| SCHEMBL23968162 | 0.80 | MELK (0.40) | MELKARL3MBTL1DRD2DRD4 | |
| SCHEMBL23968115 | 0.79 | POLB (0.42) | MELKARL3MBTL1DRD2DRD4 | |
| SCHEMBL23968099 | 0.78 | GRM4 (0.46) | MELKDRD2DRD4DRD3KMT2A |
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-3104705-B1 | CATHEPSIN CYSTEINE PROTEASE INHIBITORS | MERCK SHARP & DOHME (US) | 2021-11-03 | — | — | EP | disclosed |