Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 4/20 | 0.37 |
| ▸ | KDR | P35968 | 3/20 | 0.37 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.37 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.37 |
| ▸ | PKM | P14618 | 3/20 | 0.37 |
| ▸ | ABL1 | P00519 | 2/20 | 0.37 |
| ▸ | RET | P07949 | 2/20 | 0.37 |
| ▸ | CDK7 | P50613 | 2/20 | 0.37 |
| ▸ | PRKAA1 | Q13131 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | AURKA | O14965 | 2/20 | 0.37 |
| ▸ | JAK2 | O60674 | 2/20 | 0.37 |
| ▸ | PRKD3 | O94806 | 2/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.37 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.37 |
| ▸ | FLT1 | P17948 | 2/20 | 0.37 |
| ▸ | CLK2 | P49760 | 2/20 | 0.37 |
| ▸ | MAP4K2 | Q12851 | 2/20 | 0.37 |
| ▸ | TAOK1 | Q7L7X3 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7835407 | 0.87 | TDP1 (0.39) | DYRK1AKDRCDK5AURKBCLK4 | |
| SCHEMBL22490329 | 0.84 | KDM4E (0.40) | DYRK1AKDRCDK5AURKBCLK4 | |
| SCHEMBL5103470 | 0.80 | DYRK1A (0.39) | DYRK1AKDRCDK5AURKBCLK4 | |
| SCHEMBL2971825 | 0.80 | DYRK1A (0.39) | DYRK1AKDRCDK5AURKBCLK4 | |
| SCHEMBL2721703 | 0.80 | GAA (0.41) | DYRK1AKDRCDK5AURKBCLK4 | |
| SCHEMBL13607778 | 0.79 | RAB9A (0.51) | ALDH1A1NTRK1GSK3BLMNAMAPT | |
| SCHEMBL13607868 | 0.77 | KMT2A (0.46) | KDRCDK5AURKBCLK4ABL1 | |
| SCHEMBL13607776 | 0.77 | ALDH1A1 (0.37) | DYRK1AKDRCDK5AURKBCLK4 | |
| SCHEMBL13607866 | 0.77 | TUBB4A (0.43) | ALDH1A1NTRK1MAPTHDAC3HDAC4 | |
| SCHEMBL13607873 | 0.77 | HDAC1 (0.45) | KDRCDK5AURKBCLK4ABL1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2432779-A1 | BENZOXAZEPINES BASED P13K/MT0R INHIBITORS AGAINST PROLIFERATIVE DISEASES | Exelixis, Inc. (US) | 2012-03-28 | — | — | EP | disclosed |
| WO-2010135524-A1 | BENZOXAZEPINES BASED P13K/MT0R INHIBITORS AGAINST PROLIFERATIVE DISEASES | EXELIXIS, INC. (US) | 2010-11-25 | — | — | WO | disclosed |