Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC25B | P30305 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 9/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 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 | |
|---|---|---|---|---|
| SCHEMBL12035932 | 0.76 | ROCK2 (0.34) | ROCK2ROCK1 | |
| SCHEMBL10159136 | 0.72 | ROCK2 (0.36) | ROCK2ROCK1 | |
| SCHEMBL17453005 | 0.71 | ROCK2 (0.51) | ROCK2ROCK1 | |
| SCHEMBL30229269 | 0.69 | FABP6 (0.40) | CDC25B | |
| SCHEMBL19644130 | 0.69 | — | — | |
| SCHEMBL12273329 | 0.69 | MAOB (0.35) | — | |
| SCHEMBL17452501 | 0.68 | ROCK2 (0.41) | ROCK2ROCK1 | |
| SCHEMBL3435529 | 0.68 | CYP11B1 (0.38) | — | |
| SCHEMBL30640297 | 0.68 | MAOA (0.36) | CDC25BROCK2 | |
| SCHEMBL4507981 | 0.68 | MAOB (0.43) | CDC25B |
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-0733633-B1 | Heterocyclic compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2003-05-28 | — | — | EP | disclosed |
| EP-0733633-A1 | Heterocyclic compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-09-25 | — | — | EP | disclosed |