Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 18/20 | 0.57 |
| ▸ | KIF23 | Q02241 | 1/20 | 0.47 |
| ▸ | MAP1LC3B | Q9GZQ8 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4245132 | 0.96 | KIF11 (0.61) | KIF11KIF23MAP1LC3BCYP3A4CYP2C19 | |
| SCHEMBL4245127 | 0.96 | KIF11 (0.61) | KIF11KIF23MAP1LC3BCYP3A4CYP2C19 | |
| Trifluoroacetic Acid SCHEMBL4254477 | 0.92 | KIF11 (0.48) | KIF11KIF23MAP1LC3BCYP3A4CYP2C19 | |
| Trifluoroacetic Acid SCHEMBL4252263 | 0.91 | KIF11 (0.48) | KIF11KIF23MAP1LC3BCYP3A4CYP2C19 | |
| SCHEMBL4245634 | 0.89 | KIF11 (0.52) | KIF11KIF23MAP1LC3BCYP3A4CYP2C19 | |
| SCHEMBL4245623 | 0.89 | KIF11 (0.52) | KIF11KIF23MAP1LC3BCYP3A4CYP2C19 | |
| SCHEMBL4247294 | 0.89 | KIF11 (0.50) | KIF11KIF23MAP1LC3BCYP3A4CYP2C19 | |
| SCHEMBL4247297 | 0.89 | KIF11 (0.50) | KIF11KIF23MAP1LC3BCYP3A4CYP2C19 | |
| Trifluoroacetic Acid SCHEMBL4247939 | 0.88 | KIF11 (0.49) | KIF11KIF23MAP1LC3BCYP3A4CYP2C19 | |
| SCHEMBL4252658 | 0.88 | KIF11 (0.51) | KIF11KIF23MAP1LC3BCYP3A4CYP2C19 |
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-2035426-A1 | PYRAZOLOPYRIMIDONES | 4SC AG (DE) | 2009-03-18 | — | — | EP | disclosed |
| WO-2007144384-A1 | PYRAZOLOPYRIMIDONES | 4SC AG (DE) | 2007-12-21 | — | — | WO | disclosed |