Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 14/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 14/20 | 0.41 |
| ▸ | PDK3 | Q15120 | 14/20 | 0.41 |
| ▸ | PDK4 | Q16654 | 14/20 | 0.41 |
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL6348654 | 1.00 | PDK1 (0.41) | PDK1PDK2PDK3PDK4KIF11 | |
| SCHEMBL6351400 | 0.90 | PDK1 (0.44) | PDK1PDK2PDK3PDK4 | |
| SCHEMBL6351405 | 0.90 | PDK1 (0.44) | PDK1PDK2PDK3PDK4 | |
| SCHEMBL6358525 | 0.88 | ALDH1A1 (0.48) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL6358529 | 0.88 | ALDH1A1 (0.48) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL6571253 | 0.88 | PDK1 (0.41) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL6568763 | 0.88 | HTT (0.42) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL6568770 | 0.88 | HTT (0.42) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL6571244 | 0.88 | PDK1 (0.41) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL6571260 | 0.86 | PDK1 (0.41) | PDK1PDK2PDK3PDK4ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6960688-B2 | Use of compounds for the elevation of pyruvate dehydrogenase activity | ASTRAZENECA AB (SE) | 2005-11-01 | — | — | US | disclosed |
| US-6498275-B1 | Use of compounds for the elevation of pyruvate dehydrogenase activity | ASTRAZENECA AB (SE) | 2002-12-24 | — | — | US | disclosed |