Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | BRD4 | O60885 | 4/20 | 0.44 |
| ▸ | BRD2 | P25440 | 3/20 | 0.44 |
| ▸ | BRD3 | Q15059 | 3/20 | 0.44 |
| ▸ | PDK1 | Q15118 | 7/20 | 0.43 |
| ▸ | PDK2 | Q15119 | 7/20 | 0.43 |
| ▸ | PDK3 | Q15120 | 7/20 | 0.43 |
| ▸ | PDK4 | Q16654 | 7/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30366538 | 0.90 | PDK1 (0.47) | MAPK1ALDH1A1NPC1HTTRAB9A | |
| SCHEMBL18871760 | 0.88 | MAPK1 (0.53) | MAPK1ALDH1A1HRH3NPC1HTT | |
| SCHEMBL14756003 | 0.88 | BRD4 (0.53) | MAPK1ALDH1A1NPC1HTTRAB9A | |
| SCHEMBL30366739 | 0.87 | HSD17B3 (0.48) | MAPK1ALDH1A1NPC1HTTRAB9A | |
| SCHEMBL30366745 | 0.87 | HSD17B3 (0.48) | MAPK1ALDH1A1NPC1HTTRAB9A | |
| SCHEMBL30366544 | 0.87 | HSD17B3 (0.48) | MAPK1ALDH1A1NPC1HTTRAB9A | |
| SCHEMBL14756238 | 0.87 | HSD17B3 (0.48) | MAPK1ALDH1A1NPC1HTTRAB9A | |
| SCHEMBL26071930 | 0.87 | HSD17B3 (0.48) | MAPK1ALDH1A1NPC1HTTRAB9A | |
| SCHEMBL18871980 | 0.85 | PDK1 (0.43) | MAPK1ALDH1A1HRH3NPC1HTT | |
| SCHEMBL14755999 | 0.85 | BRD4 (0.54) | MAPK1ALDH1A1NPC1HTTRAB9A |
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-4165045-A1 | DUAL KINASE-BROMODOMAIN INHIBITORS | Monash University (AU) | 2023-04-19 | — | — | EP | disclosed |