Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.70 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.70 |
| ▸ | PDK1 | Q15118 | 12/20 | 0.60 |
| ▸ | PDK2 | Q15119 | 12/20 | 0.60 |
| ▸ | PDK3 | Q15120 | 12/20 | 0.60 |
| ▸ | PDK4 | Q16654 | 12/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.59 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.56 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.55 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.55 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.55 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL6568240 | 0.85 | PDK1 (0.61) | PDK1PDK2PDK3PDK4NR1H2 | |
| SCHEMBL6568235 | 0.85 | PDK1 (0.61) | PDK1PDK2PDK3PDK4NR1H2 | |
| SCHEMBL6345960 | 0.84 | PDK1 (0.65) | PDK1PDK2PDK3PDK4NR1H2 | |
| SCHEMBL6345956 | 0.84 | PDK1 (0.65) | PDK1PDK2PDK3PDK4NR1H2 | |
| SCHEMBL6567803 | 0.81 | PDK1 (0.65) | PDK1PDK2PDK3PDK4NR1H2 | |
| SCHEMBL6567808 | 0.81 | PDK1 (0.65) | PDK1PDK2PDK3PDK4NR1H2 | |
| SCHEMBL6568163 | 0.81 | PDK1 (0.71) | PDK1PDK2PDK3PDK4ABCC9 | |
| SCHEMBL6568929 | 0.81 | PDK1 (0.71) | PDK1PDK2PDK3PDK4 | |
| SCHEMBL6568923 | 0.81 | PDK1 (0.71) | PDK1PDK2PDK3PDK4 | |
| SCHEMBL6570941 | 0.78 | PTGES2 (0.65) | MEN1KMT2APDK1PDK2PDK3 |
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 |