Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 7/20 | 0.44 |
| ▸ | MAP2K1 | Q02750 | 2/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | PRKACA | P17612 | 1/20 | 0.40 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.40 |
| ▸ | PRKG1 | Q13976 | 1/20 | 0.40 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.40 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.40 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.40 |
| ▸ | CDC42BPA | Q5VT25 | 1/20 | 0.40 |
| ▸ | Q6ZSR9 | Q6ZSR9 | 1/20 | 0.40 |
| ▸ | BMP2K | Q9NSY1 | 1/20 | 0.40 |
| ▸ | CDC42BPB | Q9Y5S2 | 1/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.37 |
| ▸ | EGFR | P00533 | 2/20 | 0.36 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.36 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.36 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.36 |
| ▸ | SCD | O00767 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8936393 | 0.93 | ROCK1 (0.45) | ROCK1MAP2K1ROCK2PRKACAPRKCD | |
| SCHEMBL8939164 | 0.89 | ROCK1 (0.57) | ROCK1MAP2K1ROCK2PRKACAPRKCD | |
| SCHEMBL8938693 | 0.89 | MAP2K1 (0.58) | ROCK1MAP2K1ROCK2PRKACAPRKCD | |
| SCHEMBL8936391 | 0.84 | PARP1 (0.46) | ROCK1MAP2K1ROCK2PRKACAPRKCD | |
| SCHEMBL8934478 | 0.83 | ROCK1 (0.49) | ROCK1MAP2K1ROCK2PRKACAPRKCD | |
| SCHEMBL8938570 | 0.83 | ROCK1 (0.60) | ROCK1MAP2K1ROCK2PRKACAPRKCD | |
| SCHEMBL8938025 | 0.82 | ROCK1 (0.58) | ROCK1MAP2K1ROCK2PRKACAPRKCD | |
| SCHEMBL8936423 | 0.80 | ACHE (0.46) | ROCK1MAP2K1ROCK2BMP2KPDE4B | |
| SCHEMBL8934947 | 0.80 | MAP2K1 (0.60) | ROCK1MAP2K1ROCK2PRKACAPRKCD | |
| SCHEMBL8936425 | 0.80 | ACHE (0.48) | ROCK1MAP2K1 |
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 |