Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 2/20 | 0.36 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | SCN1A | P35498 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8780815 | 0.93 | ADORA2A (0.38) | MAOAMAOBPKMADORA3ADORA2A | |
| SCHEMBL8780789 | 0.92 | ADORA2A (0.41) | PKMADORA3ADORA2AADORA2BADORA1 | |
| SCHEMBL8780919 | 0.89 | HRH3 (0.41) | MAOAMAOBPKMADORA3ADORA2A | |
| SCHEMBL8780859 | 0.86 | SLC22A2 (0.42) | KCNH2BCHECYP1A2MAPT | |
| SCHEMBL8780802 | 0.86 | L3MBTL1 (0.44) | MAOBPKMBCHEACHEGAA | |
| Hydrochloric Acid SCHEMBL8781133 | 0.85 | L3MBTL1 (0.43) | MAOBPKMBCHEACHEGAA | |
| SCHEMBL8780890 | 0.85 | PKM (0.52) | PKMKCNH2LMNAKMT2A | |
| SCHEMBL8780990 | 0.85 | KCNH2 (0.39) | PKMADORA3ADORA2AADORA2BADORA1 | |
| SCHEMBL8780940 | 0.85 | ADORA2A (0.43) | PKMADORA3ADORA2AADORA2BADORA1 | |
| SCHEMBL8780889 | 0.85 | SLC22A2 (0.40) | KCNH2CYP3A4CYP2D6DRD3MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0697407-B1 | Pyrimidinedione derivatives and antiarrhythmic compositions containing same | MITSUI TOATSU CHEMICALS (JP) | 1997-06-25 | — | — | EP | disclosed |
| EP-0697407-A1 | Pyrimidinedione derivatives and antiarrhythmic compositions containing same | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1996-02-21 | — | — | EP | disclosed |