Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 1/20 | 0.53 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | PDE4A | P27815 | 3/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | IRAK4 | Q9NWZ3 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | NSD2 | O96028 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3628370 | 1.00 | ROCK2 (0.53) | ROCK2ROCK1GAAPDE4APDE4B | |
| SCHEMBL3627682 | 0.89 | GAA (0.49) | ROCK2ROCK1GAAPDE4APDE4B | |
| SCHEMBL3627678 | 0.89 | GAA (0.49) | ROCK2ROCK1GAAPDE4APDE4B | |
| SCHEMBL3627803 | 0.88 | LMNA (0.49) | ROCK2ROCK1GAAPDE4APDE4B | |
| SCHEMBL3628130 | 0.88 | ROCK2 (0.43) | ROCK2ROCK1GAAPDE4APDE4B | |
| SCHEMBL3627799 | 0.88 | LMNA (0.49) | ROCK2ROCK1GAAPDE4APDE4B | |
| SCHEMBL3628132 | 0.88 | ROCK2 (0.43) | ROCK2ROCK1GAAPDE4APDE4B | |
| SCHEMBL3630214 | 0.87 | GAA (0.47) | ROCK2ROCK1GAAHPGDRXFP1 | |
| SCHEMBL3630218 | 0.87 | GAA (0.47) | ROCK2ROCK1GAAHPGDRXFP1 | |
| SCHEMBL3630694 | 0.86 | ROCK2 (0.41) | ROCK2ROCK1PDE4APDE4BPDE4C |
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-2010032875-A2 | HETEROCYCLIC CARBOXAMIDE COMPOUNDS | ASTELLAS PHARMA INC. (JP) | 2010-03-25 | — | — | WO | disclosed |