Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 7/20 | 0.68 |
| ▸ | AURKB | Q96GD4 | 6/20 | 0.68 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.68 |
| ▸ | YES1 | P07947 | 2/20 | 0.68 |
| ▸ | PIM1 | P11309 | 1/20 | 0.68 |
| ▸ | WNT1 | P04628 | 4/20 | 0.56 |
| ▸ | GSK3B | P49841 | 4/20 | 0.56 |
| ▸ | DYRK1A | Q13627 | 4/20 | 0.56 |
| ▸ | ABL1 | P00519 | 1/20 | 0.55 |
| ▸ | FGFR3 | P22607 | 3/20 | 0.49 |
| ▸ | FGFR4 | P22455 | 2/20 | 0.49 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.49 |
| ▸ | FGFR2 | P21802 | 2/20 | 0.49 |
| ▸ | KDR | P35968 | 1/20 | 0.49 |
| ▸ | MET | P08581 | 3/20 | 0.49 |
| ▸ | MST1R | Q04912 | 1/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL17240002 | 0.88 | MAPK1 (0.68) | MAPK1AURKBNTRK1YES1PIM1 | |
| SCHEMBL1933387 | 0.81 | MAPK1 (1.00) | MAPK1AURKBNTRK1YES1PIM1 | |
| SCHEMBL15884535 | 0.79 | MAPK1 (0.67) | MAPK1AURKBNTRK1YES1PIM1 | |
| SCHEMBL1933036 | 0.79 | MAPK1 (0.88) | MAPK1AURKBNTRK1YES1PIM1 | |
| SCHEMBL1933048 | 0.79 | MAPK1 (1.00) | MAPK1AURKBNTRK1YES1PIM1 | |
| SCHEMBL20950383 | 0.79 | WNT1 (0.77) | MAPK1AURKBNTRK1YES1PIM1 | |
| SCHEMBL1932302 | 0.76 | AURKB (1.00) | MAPK1AURKBNTRK1YES1PIM1 | |
| SCHEMBL17251852 | 0.76 | MAPK1 (0.60) | MAPK1AURKBNTRK1YES1PIM1 | |
| SCHEMBL15884456 | 0.74 | AURKB (0.59) | MAPK1AURKBNTRK1YES1PIM1 | |
| SCHEMBL20947644 | 0.73 | DYRK1A (0.71) | MAPK1AURKBNTRK1YES1PIM1 |
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-2944637-B1 | NITROGEN-CONTAINING HETEROCYLIC COMPOUND OR SALT THEREOF | FUJIFILM CORP (JP) | 2020-02-19 | — | — | EP | disclosed |