Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.53 |
| ▸ | MAOB | P27338 | 1/20 | 0.53 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.51 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.48 |
| ▸ | PARP1 | P09874 | 2/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | HRH1 | P35367 | 4/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8939214 | 0.89 | ROCK1 (0.54) | MAOAMAOBROCK1HRH3KCNH2 | |
| SCHEMBL14981035 | 0.85 | ROCK1 (0.49) | MAOAMAOBROCK1HRH3PARP1 | |
| SCHEMBL8939223 | 0.83 | HRH3 (0.53) | ROCK1HRH3KCNH2ROCK2 | |
| SCHEMBL8939231 | 0.82 | HRH1 (0.42) | MAOAMAOBHRH3KCNH2HRH1 | |
| SCHEMBL8148282 | 0.81 | ROCK1 (0.57) | ROCK1KCNH2ROCK2 | |
| SCHEMBL12192818 | 0.80 | MAOA (0.54) | MAOAMAOBROCK1HRH3PARP1 | |
| SCHEMBL12192816 | 0.76 | IKBKB (0.51) | MAOAMAOBROCK1HRH3PARP1 | |
| SCHEMBL8934752 | 0.76 | ROCK1 (0.61) | MAOAMAOBROCK1HRH3PARP1 | |
| SCHEMBL12192817 | 0.76 | ROCK1 (0.50) | MAOAMAOBROCK1HRH3PARP1 | |
| SCHEMBL8939229 | 0.75 | IGF1R (0.39) | ROCK1HRH3KCNH2HRH1HTR1A |
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 2 patents. 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 |
| US-8188117-B2 | Piperidinyl-substituted isoquinolone derivatives | SANOFI-AVENTIS (FR) | 2012-05-29 | — | — | US | disclosed |