Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 4/20 | 0.44 |
| ▸ | BRD4 | O60885 | 5/20 | 0.37 |
| ▸ | EP300 | Q09472 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | CCR3 | P51677 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 7/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 7/20 | 0.34 |
| ▸ | PDE4A | P27815 | 6/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 6/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | VEGFA | P15692 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | PDE5A | O76074 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8936615 | 0.89 | HRH3 (0.40) | ROCK1HRH1CCR3 | |
| SCHEMBL3229103 | 0.89 | ROCK1 (0.43) | ROCK1HRH1CCR3 | |
| SCHEMBL8934493 | 0.87 | MAOA (0.39) | ROCK1BRD4HRH1CCR3LMNA | |
| SCHEMBL8936609 | 0.86 | OPRM1 (0.41) | HRH1CCR3 | |
| SCHEMBL8938566 | 0.85 | ROCK1 (0.35) | ROCK1BRD4HRH1CCR3PDE4B | |
| SCHEMBL8936493 | 0.84 | HRH1 (0.42) | ROCK1HRH1CCR3 | |
| SCHEMBL8936533 | 0.81 | HRH1 (0.46) | ROCK1HRH1CCR3 | |
| SCHEMBL8936483 | 0.81 | MAOA (0.46) | HRH1CCR3CYP2C9 | |
| SCHEMBL8936920 | 0.80 | PARP14 (0.40) | ROCK1HRH1CCR3 | |
| SCHEMBL8936719 | 0.80 | HRH1 (0.42) | HRH1CCR3 |
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 |