Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP2K1 | Q02750 | 2/20 | 0.49 |
| ▸ | SCN8A | Q9UQD0 | 13/20 | 0.41 |
| ▸ | SCN1A | P35498 | 12/20 | 0.41 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 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 | |
|---|---|---|---|---|
| SCHEMBL8935032 | 0.93 | MAP2K1 (0.51) | MAP2K1SCN8ASCN1AENPP2 | |
| SCHEMBL8939121 | 0.92 | ROCK1 (0.48) | MAP2K1SCN8ASCN1AENPP2ROCK1 | |
| SCHEMBL8935015 | 0.89 | MAP2K1 (0.53) | MAP2K1SCN8ASCN1AROCK1 | |
| SCHEMBL8938735 | 0.88 | MAP2K1 (0.52) | MAP2K1SCN8ASCN1AENPP2ROCK1 | |
| SCHEMBL8935011 | 0.86 | MAP2K1 (0.54) | MAP2K1SCN8ASCN1AENPP2ROCK1 | |
| SCHEMBL8937905 | 0.85 | ROCK1 (0.48) | MAP2K1SCN8ASCN1AENPP2ROCK1 | |
| SCHEMBL8938150 | 0.85 | MAP2K1 (0.57) | MAP2K1ENPP2ROCK1 | |
| SCHEMBL8935003 | 0.85 | MAP2K1 (0.57) | MAP2K1SCN8ASCN1AROCK1 | |
| SCHEMBL8938278 | 0.85 | MAP2K1 (0.59) | MAP2K1SCN8ASCN1AROCK1 | |
| SCHEMBL8938170 | 0.83 | MAP2K1 (0.55) | MAP2K1ENPP2ROCK1 |
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 |