Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM5 | P08912 | 4/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | KCNA5 | P22460 | 5/20 | 0.37 |
| ▸ | SCN5A | Q14524 | 5/20 | 0.37 |
| ▸ | KCND2 | Q9NZV8 | 5/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16991924 | 0.91 | NAAA (0.38) | KMT2AMEN1ALDH1A1SIGMAR1 | |
| SCHEMBL17002531 | 0.80 | PDE4B (0.44) | KMT2AMEN1ALDH1A1MAPT | |
| SCHEMBL22828894 | 0.79 | HIF1A (0.34) | — | |
| SCHEMBL16992328 | 0.78 | OXTR (0.42) | KMT2AMEN1ALDH1A1 | |
| SCHEMBL16992111 | 0.76 | DRD4 (0.40) | CHRM5CHRM1CHRM3KMT2AMEN1 | |
| SCHEMBL18300898 | 0.76 | QDPR (0.50) | ALDH1A1 | |
| SCHEMBL16992525 | 0.75 | PDE4B (0.37) | — | |
| SCHEMBL16992106 | 0.73 | HCRTR1 (0.48) | — | |
| SCHEMBL16991981 | 0.72 | PDE2A (0.39) | — | |
| SCHEMBL18300854 | 0.71 | CTSK (0.48) | KMT2AMEN1ALDH1A1MAPT |
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-3104860-B1 | PHARMACEUTICAL COMPOUNDS AS CHK1 INHIBITORS | SENTINEL ONCOLOGY LTD (GB) | 2020-12-30 | — | — | EP | disclosed |