Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MELK | Q14680 | 1/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.37 |
| ▸ | RET | P07949 | 7/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.34 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.33 |
| ▸ | P2RX2 | Q9UBL9 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | BMP4 | P12644 | 1/20 | 0.33 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL23968021 | 0.87 | MELK (0.37) | MELKRET | |
| SCHEMBL23968116 | 0.87 | MELK (0.39) | MELKRETP2RX3P2RX2GAA | |
| SCHEMBL23968184 | 0.84 | MELK (0.39) | MELKRET | |
| SCHEMBL23968104 | 0.83 | CCNT1 (0.42) | MELKRET | |
| SCHEMBL23968094 | 0.81 | MELK (0.40) | MELKRET | |
| SCHEMBL23968093 | 0.80 | MAP4K4 (0.54) | MELKMAP4K4AKR1C3MAPT | |
| SCHEMBL23968097 | 0.79 | MELK (0.39) | MELKRETHSD17B10 | |
| SCHEMBL23968007 | 0.78 | ALDH1A1 (0.44) | MELKMAP4K4AKR1C3MAPT | |
| SCHEMBL23968098 | 0.77 | MELK (0.48) | MELKMAP4K4RET | |
| SCHEMBL23968008 | 0.76 | MELK (0.41) | MELKMAP4K4MAPTCNR2 |
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 |