Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPKAPK2 | P49137 | 10/20 | 0.37 |
| ▸ | PLK1 | P53350 | 3/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.37 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.37 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.37 |
| ▸ | CDC42BPA | Q5VT25 | 2/20 | 0.37 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.37 |
| ▸ | PIM1 | P11309 | 1/20 | 0.37 |
| ▸ | PLK3 | Q9H4B4 | 1/20 | 0.37 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.34 |
| ▸ | GSK3A | P49840 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.34 |
| ▸ | PRKX | P51817 | 1/20 | 0.34 |
| ▸ | NEK4 | P51957 | 1/20 | 0.34 |
| ▸ | CSNK1G2 | P78368 | 1/20 | 0.34 |
| ▸ | BRSK1 | Q8TDC3 | 1/20 | 0.34 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.34 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19286176 | 0.77 | MAPT (0.50) | TACR1 | |
| SCHEMBL17470039 | 0.77 | MAPT (0.50) | TACR1 | |
| SCHEMBL19286260 | 0.75 | PLK1 (0.32) | MAPKAPK2PLK1ROCK1AURKBROCK2 | |
| SCHEMBL19286294 | 0.75 | CA1 (0.33) | MAPKAPK2PLK1ROCK1AURKBROCK2 | |
| SCHEMBL19286296 | 0.73 | CCR6 (0.32) | MAPKAPK2PLK1ROCK1AURKBROCK2 | |
| SCHEMBL19286227 | 0.73 | KAT2B (0.35) | MAPKAPK2PLK1ROCK1AURKBROCK2 | |
| SCHEMBL17470169 | 0.73 | PLK1 (0.37) | MAPKAPK2PLK1ROCK1AURKBROCK2 | |
| SCHEMBL19286258 | 0.73 | KDM4E (0.34) | CYP2D6MAPK1 | |
| SCHEMBL19286229 | 0.72 | KAT2B (0.37) | MAPKAPK2PLK1ROCK1AURKBROCK2 | |
| SCHEMBL17470132 | 0.72 | MAPKAPK2 (0.38) | MAPKAPK2PLK1ROCK1AURKBROCK2 |
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 |
|---|---|---|---|---|---|---|---|
| US-9744528-B2 | Metallorganocatalysis for asymmetric transformations | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2017-08-29 | — | — | US | disclosed |