Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 14/20 | 0.53 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.53 |
| ▸ | PRKCD | Q05655 | 2/20 | 0.53 |
| ▸ | PRKACA | P17612 | 1/20 | 0.53 |
| ▸ | PRKG1 | Q13976 | 1/20 | 0.53 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.53 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.53 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.53 |
| ▸ | CDC42BPA | Q5VT25 | 1/20 | 0.53 |
| ▸ | Q6ZSR9 | Q6ZSR9 | 1/20 | 0.53 |
| ▸ | BMP2K | Q9NSY1 | 1/20 | 0.53 |
| ▸ | CDC42BPB | Q9Y5S2 | 1/20 | 0.53 |
| ▸ | PRKX | P51817 | 1/20 | 0.48 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.48 |
| ▸ | PRKD1 | Q15139 | 1/20 | 0.48 |
| ▸ | MAOA | P21397 | 4/20 | 0.46 |
| ▸ | MAOB | P27338 | 4/20 | 0.46 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.44 |
| ▸ | CCR2 | P41597 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8934866 | 0.92 | ROCK1 (0.55) | ROCK1ROCK2PRKCDPRKACAPRKG1 | |
| SCHEMBL4007501 | 0.87 | ROCK1 (0.58) | ROCK1ROCK2PRKCDPRKACAPRKG1 | |
| SCHEMBL4013793 | 0.87 | ROCK1 (0.58) | ROCK1ROCK2PRKCDPRKACAPRKG1 | |
| SCHEMBL8934763 | 0.86 | ROCK1 (0.60) | ROCK1ROCK2PRKCDPRKACAPRKG1 | |
| SCHEMBL8938735 | 0.85 | MAP2K1 (0.52) | ROCK1ROCK2PRKACAMAOAMAOB | |
| SCHEMBL8939149 | 0.85 | ROCK1 (0.51) | ROCK1PRKACAMAOAMAOBADRB2 | |
| SCHEMBL4005889 | 0.85 | ROCK1 (0.61) | ROCK1ROCK2PRKCDPRKACAPRKG1 | |
| SCHEMBL8938787 | 0.84 | ROCK1 (0.50) | ROCK1ROCK2MAOAMAOBADRB2 | |
| SCHEMBL8934869 | 0.84 | ROCK1 (0.54) | ROCK1ROCK2PRKCDPRKACAPRKG1 | |
| SCHEMBL8939053 | 0.83 | MAOA (0.45) | ROCK1ROCK2MAOAMAOBADRB2 |
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 |
|---|---|---|---|---|---|---|---|
| US-8188117-B2 | Piperidinyl-substituted isoquinolone derivatives | SANOFI-AVENTIS (FR) | 2012-05-29 | — | — | US | disclosed |