Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 9/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 9/20 | 0.43 |
| ▸ | PRKX | P51817 | 1/20 | 0.43 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.43 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.43 |
| ▸ | PRKD1 | Q15139 | 1/20 | 0.43 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.42 |
| ▸ | FEN1 | P39748 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | COMT | P21964 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | THPO | P40225 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5086217 | 0.95 | SMN1; SMN2 (0.46) | ROCK2ROCK1PRKXPRKCEPRKCD | |
| SCHEMBL5083072 | 0.91 | ROCK2 (0.49) | ROCK2ROCK1PRKXPRKCEPRKCD | |
| SCHEMBL4728460 | 0.88 | ALOX5AP (0.45) | ROCK2ROCK1PRKXPRKCEPRKCD | |
| SCHEMBL4728648 | 0.85 | ROCK2 (0.45) | ROCK2ROCK1PRKXPRKCEPRKCD | |
| SCHEMBL5086408 | 0.81 | CHRM1 (0.50) | ROCK2ROCK1PRKXPRKCEPRKCD | |
| SCHEMBL4728126 | 0.81 | ROCK2 (0.43) | ROCK2ROCK1PRKXPRKCEPRKCD | |
| SCHEMBL4726171 | 0.81 | CCR6 (0.47) | ROCK2ROCK1PRKXPRKCEPRKCD | |
| SCHEMBL4732315 | 0.78 | MAPK1 (0.50) | SMN1; SMN2EPHX2 | |
| SCHEMBL4725363 | 0.78 | ROCK2 (0.48) | ROCK2ROCK1PRKXPRKCEPRKCD | |
| SCHEMBL2907238 | 0.77 | POLB (0.56) | ROCK2ROCK1PRKXPRKCEPRKCD |
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-2008021210-A2 | METHODS AND COMPOSITIONS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS | COMBINATORX, INCORPORATED (US) | 2008-02-21 | — | — | WO | disclosed |