Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 7/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CDC42BPA | Q5VT25 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.34 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.34 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.33 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.33 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SCD | O00767 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.32 |
| ▸ | HTR5A | P47898 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11892993 | 0.95 | ROCK2 (0.39) | ROCK2ROCK1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL1496829 | 0.90 | ROCK2 (0.43) | ROCK2ROCK1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL12831883 | 0.89 | RAF1 (0.37) | ROCK2ROCK1HDAC1P2RX3PDCD1 | |
| SCHEMBL1496858 | 0.89 | MEN1 (0.41) | ROCK2ROCK1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8001973 | 0.89 | ROCK2 (0.47) | ROCK2ROCK1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL1497472 | 0.89 | ROCK2 (0.39) | ROCK2ROCK1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL1497449 | 0.88 | ROCK2 (0.42) | ROCK2ROCK1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL1496834 | 0.88 | ROCK2 (0.46) | ROCK2ROCK1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL1496905 | 0.88 | ROCK2 (0.39) | ROCK2ROCK1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL12831865 | 0.88 | ROCK2 (0.41) | ROCK2ROCK1CYP3A4CYP2D6CYP2C9 |
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-2292611-A1 | NOVEL THIOPHENEDIAMINE DERIVATIVE HAVING UREA STRUCTURE | Santen Pharmaceutical Co., Ltd (JP) | 2011-03-09 | — | — | EP | disclosed |
| WO-2009142321-A1 | NOVEL THIOPHENEDIAMINE DERIVATIVE HAVING UREA STRUCTURE | 参天製薬株式会社 (JP) | 2009-11-26 | — | — | WO | disclosed |