Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLK1 | P06870 | 1/20 | 0.51 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.51 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.49 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.48 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.48 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.46 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL13111069 | 0.82 | PDE4B (0.52) | KLK1KLK5PDE4BPDE4CPDE4D | |
| SCHEMBL13394055 | 0.82 | PDE4B (0.52) | KLK1KLK5PDE4BROCK2ROCK1 | |
| SCHEMBL13111042 | 0.81 | PDE4B (0.52) | KLK1KLK5PDE4BPDE4CPDE4D | |
| SCHEMBL3473946 | 0.81 | PDE4A (0.56) | KLK1KLK5PDE4BPDE4CPDE4D | |
| SCHEMBL13637219 | 0.80 | KLK1 (0.64) | KLK1KLK5PDE4BPDE4CPDE4D | |
| SCHEMBL13394098 | 0.79 | ROCK2 (0.51) | KLK1KLK5PDE4BPDE4CPDE4D | |
| SCHEMBL13637188 | 0.79 | CA12 (0.57) | KLK1KLK5PDE4BROCK2ROCK1 | |
| SCHEMBL13111041 | 0.79 | PDE4B (0.57) | KLK1KLK5PDE4BPDE4CPDE4D | |
| SCHEMBL3473905 | 0.78 | CA12 (0.53) | KLK1KLK5PDE4BPDE4CPDE4D | |
| SCHEMBL13111070 | 0.77 | KLK1 (0.51) | KLK1KLK5PDE4BPDE4CPDE4D |
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-2009140309-A2 | BORON-CONTAINING SMALL MOLECULES | ANACOR PHARMACEUTICALS, INC. (US) | 2009-11-19 | — | — | WO | disclosed |