Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 20/20 | 0.62 |
| ▸ | ROCK1 | Q13464 | 12/20 | 0.62 |
| ▸ | CCR2 | P41597 | 7/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL5637999 | 0.94 | ROCK2 (0.65) | ROCK2ROCK1CCR2CYP3A4 | |
| SCHEMBL5640872 | 0.89 | ROCK2 (0.62) | ROCK2ROCK1CCR2CYP3A4 | |
| SCHEMBL5641255 | 0.88 | ROCK2 (0.66) | ROCK2ROCK1CCR2CYP3A4 | |
| SCHEMBL5641095 | 0.88 | ROCK2 (0.73) | ROCK2ROCK1CCR2 | |
| SCHEMBL10262828 | 0.86 | ROCK2 (0.67) | ROCK2ROCK1CCR2CYP3A4 | |
| SCHEMBL1716391 | 0.85 | ROCK2 (0.69) | ROCK2ROCK1CCR2CYP3A4 | |
| SCHEMBL1716613 | 0.85 | ROCK2 (0.66) | ROCK2ROCK1CCR2CYP3A4 | |
| SCHEMBL1716552 | 0.85 | ROCK2 (0.66) | ROCK2ROCK1CCR2CYP3A4 | |
| SCHEMBL1716330 | 0.83 | ROCK2 (0.76) | ROCK2ROCK1CCR2CYP3A4 | |
| SCHEMBL1716785 | 0.83 | ROCK2 (0.70) | ROCK2ROCK1CCR2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-7217722-B2 | Nitrogen-containing compounds having kinase inhibitory activity and drugs containing the same | KIRIN BEER KABUSHIKI KAISHA (JP) | 2007-05-15 | — | — | US | disclosed |
| US-7217722-B2 | Nitrogen-containing compounds having kinase inhibitory activity and drugs containing the same | KIRIN BEER KABUSHIKI KAISHA (JP) | 2007-05-15 | — | — | US | disclosed |