Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 8/20 | 0.50 |
| ▸ | ROCK1 | Q13464 | 7/20 | 0.50 |
| ▸ | PRKACA | P17612 | 2/20 | 0.50 |
| ▸ | PRKX | P51817 | 2/20 | 0.50 |
| ▸ | PRKCQ | Q04759 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | GSK3A | P49840 | 1/20 | 0.50 |
| ▸ | GSK3B | P49841 | 1/20 | 0.50 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.50 |
| ▸ | MMP13 | P45452 | 2/20 | 0.49 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.47 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.47 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.46 |
| ▸ | FLT4 | P35916 | 1/20 | 0.46 |
| ▸ | GRK5 | P34947 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4729418 | 0.93 | MEN1 (0.44) | ROCK2ROCK1PRKACAPRKXPRKCQ | |
| SCHEMBL4729229 | 0.90 | MEN1 (0.52) | ROCK2 | |
| SCHEMBL4727856 | 0.88 | MEN1 (0.45) | CYP3A4L3MBTL1 | |
| SCHEMBL4781615 | 0.85 | HPGD (0.51) | ROCK2ROCK1TP53 | |
| SCHEMBL4727301 | 0.82 | STIM1 (0.46) | TP53 | |
| SCHEMBL4727417 | 0.80 | STIM1 (0.44) | — | |
| SCHEMBL4727073 | 0.79 | MAPK14 (0.48) | MAPK14MAPK11 | |
| SCHEMBL4728221 | 0.78 | HPGD (0.48) | ROCK2CYP2C9MAPK14L3MBTL1 | |
| SCHEMBL4727373 | 0.76 | RAF1 (0.47) | MAPK14 | |
| SCHEMBL4782260 | 0.76 | MEN1 (0.51) | ROCK2ROCK1CYP3A4MMP13MAPK14 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008021388-A1 | HETEROARYL DERIVATIVES AS CYTOKINE INHIBITORS | KEMIA, INC. (US) | 2008-02-21 | — | — | WO | disclosed |