Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 10/20 | 0.39 |
| ▸ | CCR3 | P51677 | 10/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.36 |
| ▸ | S1PR5 | Q9H228 | 3/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8935557 | 0.93 | HRH1 (0.40) | HRH1CCR3ROCK1KCNH2PARP1 | |
| SCHEMBL8935395 | 0.86 | PARP1 (0.43) | HRH1CCR3ROCK1KCNH2PARP1 | |
| SCHEMBL8938757 | 0.85 | ROCK1 (0.56) | HRH1CCR3ROCK1KCNH2PARP1 | |
| SCHEMBL8935399 | 0.84 | MAOA (0.46) | HRH1CCR3ROCK1KCNH2PARP1 | |
| SCHEMBL8939164 | 0.84 | ROCK1 (0.57) | HRH1CCR3ROCK1KCNH2 | |
| SCHEMBL8935441 | 0.84 | HRH1 (0.41) | HRH1CCR3ROCK1KCNH2S1PR5 | |
| SCHEMBL8935529 | 0.83 | PARP1 (0.44) | HRH1CCR3ROCK1KCNH2PARP1 | |
| SCHEMBL8934495 | 0.82 | ROCK1 (0.42) | HRH1CCR3ROCK1KCNH2PARP1 | |
| SCHEMBL8935499 | 0.82 | HRH1 (0.41) | HRH1CCR3ROCK1KCNH2S1PR5 | |
| SCHEMBL8939077 | 0.81 | HRH1 (0.35) | HRH1CCR3KCNH2PARP1ADRA1D |
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 |