Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 4/20 | 0.36 |
| ▸ | USP2 | O75604 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | TNF | P01375 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL26093305 | 1.00 | ALDH1A1 (0.39) | ALDH1A1MAPTHTTHCAR2KEAP1 | |
| SCHEMBL16114006 | 0.84 | HCAR2 (0.44) | ALDH1A1MAPTHTTHCAR2SMN1; SMN2 | |
| SCHEMBL30153938 | 0.83 | HCAR2 (0.41) | HCAR2KEAP1NFE2L2L3MBTL1SMN1; SMN2 | |
| SCHEMBL30622827 | 0.82 | HCAR2 (0.44) | ALDH1A1MAPTHTTHCAR2KEAP1 | |
| SCHEMBL16140874 | 0.82 | HCAR2 (0.44) | ALDH1A1MAPTHTTHCAR2KEAP1 | |
| SCHEMBL25301 | 0.81 | HCAR2 (0.43) | ALDH1A1MAPTHCAR2KEAP1NFE2L2 | |
| SCHEMBL25300 | 0.81 | HCAR2 (0.43) | ALDH1A1MAPTHCAR2KEAP1NFE2L2 | |
| SCHEMBL30418583 | 0.80 | USP2 (0.43) | ALDH1A1MAPTHTTL3MBTL1MAPK1 | |
| SCHEMBL27216617 | 0.80 | HCAR2 (0.35) | ALDH1A1MAPTHTTHCAR2KEAP1 | |
| SCHEMBL5857768 | 0.76 | SIGMAR1 (0.50) | ALDH1A1SMN1; SMN2LMNAMEN1KMT2A |
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-2023067353-A1 | HETEROCYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF CANCER | ARTIOS PHARMA LIMITED (GB) | 2023-04-27 | — | — | WO | disclosed |