Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | NAMPT | P43490 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.37 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.35 |
| ▸ | CSNK1G2 | P78368 | 1/20 | 0.35 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.35 |
| ▸ | MAP4K5 | Q9Y4K4 | 1/20 | 0.35 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.34 |
| ▸ | CTNNB1 | P35222 | 2/20 | 0.34 |
| ▸ | WNT3A | P56704 | 2/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1759261 | 0.84 | DYRK1A (0.52) | DYRK1AHDAC1NAMPTKDM4EALDH1A1 | |
| SCHEMBL1894052 | 0.81 | DYRK1A (0.46) | DYRK1AHDAC1NAMPTKDM4EALDH1A1 | |
| SCHEMBL30174393 | 0.81 | DYRK1A (0.46) | DYRK1AHDAC1NAMPTKDM4EALDH1A1 | |
| SCHEMBL4145078 | 0.81 | DYRK1A (0.46) | DYRK1AHDAC1NAMPTNTRK1ROCK2 | |
| SCHEMBL31194336 | 0.74 | PIK3C3 (0.50) | KDM4EALDH1A1MAPTNTRK1ROCK2 | |
| SCHEMBL12709594 | 0.74 | PIK3C3 (0.50) | KDM4EALDH1A1MAPTNTRK1ROCK2 | |
| SCHEMBL16864218 | 0.73 | PIK3C3 (0.48) | NAMPTKDM4EALDH1A1MAPTROCK2 | |
| SCHEMBL30194367 | 0.71 | MAPT (0.68) | DYRK1AKDM4EALDH1A1MAPTROCK2 | |
| SCHEMBL2933207 | 0.71 | MAPT (0.68) | DYRK1AKDM4EALDH1A1MAPTROCK2 | |
| SCHEMBL8296666 | 0.71 | DYRK1A (0.59) | DYRK1AKDM4EALDH1A1MAPTCTNNB1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2676958-B1 | N1-Pyrazolospiroketone acetyl-CoA carboxylase inhibitors | PFIZER (US) | 2015-07-01 | — | — | EP | disclosed |
| WO-2012056372-A1 | N1/N2-LACTAM ACETYL-CoA CARBOXYLASE INHIBITORS | PFIZER INC. (US) | 2012-05-03 | — | — | WO | disclosed |
| WO-2011058474-A1 | N1-PYRAZOLOSPIROKETONE ACETYL-COA CARBOXYLASE INHIBITORS | PFIZER INC. (US) | 2011-05-19 | — | — | WO | disclosed |