Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 17/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 17/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | HTR2C | P28335 | 2/20 | 0.40 |
| ▸ | HTR2B | P41595 | 2/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8939229 | 0.94 | IGF1R (0.39) | HRH1KCNH2HTR2CHTR2BHRH3 | |
| SCHEMBL8939216 | 0.82 | MAOA (0.53) | HRH1KCNH2HRH3MAOAMAOB | |
| SCHEMBL8934714 | 0.81 | HRH3 (0.39) | CYP3A4CYP2D6HRH3 | |
| SCHEMBL8934924 | 0.78 | MAP2K1 (0.58) | HRH1KCNH2HRH3MAOAMAOB | |
| SCHEMBL2337307 | 0.77 | KMO (0.41) | — | |
| SCHEMBL2337304 | 0.77 | KMO (0.41) | — | |
| SCHEMBL8934704 | 0.77 | MAP2K1 (0.50) | HRH1 | |
| Hydrochloric Acid SCHEMBL2338809 | 0.76 | KMO (0.41) | — | |
| SCHEMBL4608510 | 0.76 | KMO (0.41) | — | |
| SCHEMBL4961099 | 0.76 | KMO (0.41) | — |
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 |