Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 15/20 | 0.61 |
| ▸ | PDK2 | Q15119 | 15/20 | 0.61 |
| ▸ | PDK3 | Q15120 | 15/20 | 0.61 |
| ▸ | PDK4 | Q16654 | 15/20 | 0.61 |
| ▸ | LMNA | P02545 | 3/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.59 |
| ▸ | PKM | P14618 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.59 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.59 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.59 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.56 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL5737324 | 0.96 | PDK1 (0.64) | PDK1PDK2PDK3PDK4LMNA | |
| SCHEMBL6571391 | 0.88 | PDK1 (0.61) | PDK1PDK2PDK3PDK4PTGES2 | |
| SCHEMBL5738183 | 0.87 | PDK1 (0.68) | PDK1PDK2PDK3PDK4PTGES2 | |
| SCHEMBL5749870 | 0.86 | PDK1 (0.64) | PDK1PDK2PDK3PDK4PTGES2 | |
| SCHEMBL6357232 | 0.85 | NR1H2 (0.65) | PDK1PDK2PDK3PDK4PTGES2 | |
| SCHEMBL6568195 | 0.85 | PDK1 (0.65) | PDK1PDK2PDK3PDK4PTGES2 | |
| SCHEMBL6569607 | 0.84 | PDK1 (0.64) | PDK1PDK2PDK3PDK4PTGES2 | |
| SCHEMBL6568179 | 0.84 | PDK1 (0.64) | PDK1PDK2PDK3PDK4PTGES2 | |
| SCHEMBL5737838 | 0.83 | PDK1 (0.69) | PDK1PDK2PDK3PDK4LMNA | |
| SCHEMBL6570941 | 0.83 | PTGES2 (0.65) | PDK1PDK2PDK3PDK4MEN1 |
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-1082110-B1 | USE OF COMPOUNDS FOR THE ELEVATION OF PYRUVATE DEHYDROGENASE ACTIVITY | ASTRAZENECA AB (SE) | 2004-03-24 | — | — | EP | disclosed |