Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 2/20 | 0.40 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.40 |
| ▸ | PDK3 | Q15120 | 2/20 | 0.40 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.40 |
| ▸ | SIRT1 | Q96EB6 | 2/20 | 0.36 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.36 |
| ▸ | MTOR | P42345 | 2/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | HCK | P08631 | 1/20 | 0.36 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.36 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.36 |
| ▸ | PRKDC | P78527 | 1/20 | 0.36 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.36 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.35 |
| ▸ | MKNK2 | Q9HBH9 | 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 | |
|---|---|---|---|---|
| SCHEMBL30015877 | 1.00 | PDK1 (0.40) | PDK1PDK2PDK3PDK4SIRT1 | |
| SCHEMBL24699474 | 0.88 | MTOR (0.44) | PDK1PDK2PDK3PDK4SIRT1 | |
| SCHEMBL30016341 | 0.88 | MTOR (0.44) | PDK1PDK2PDK3PDK4SIRT1 | |
| SCHEMBL30015382 | 0.88 | PDK1 (0.39) | PDK1PDK2PDK3PDK4SIRT1 | |
| SCHEMBL24699353 | 0.88 | PDK1 (0.39) | PDK1PDK2PDK3PDK4SIRT1 | |
| SCHEMBL24699484 | 0.87 | PDE7A (0.41) | PDK1PDK2PDK3PDK4MTOR | |
| SCHEMBL30015689 | 0.87 | PDE7A (0.41) | PDK1PDK2PDK3PDK4MTOR | |
| SCHEMBL24698763 | 0.86 | PDK1 (0.39) | PDK1PDK2PDK3PDK4MTOR | |
| SCHEMBL30016009 | 0.86 | PDK1 (0.39) | PDK1PDK2PDK3PDK4MTOR | |
| SCHEMBL24698163 | 0.85 | PDK2 (0.36) | PDK1PDK2PDK3PDK4SIRT1 |
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-2022212194-A1 | KHK INHIBITORS | GILEAD SCIENCES, INC. (US) | 2022-10-06 | — | — | WO | disclosed |