Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 4/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.31 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18542779 | 0.80 | PIK3CD (0.37) | PIK3CDHRH3SMN1; SMN2CYP2D6KDM4E | |
| SCHEMBL15332381 | 0.79 | PIK3CD (0.42) | PIK3CDHRH3SMN1; SMN2CYP2D6KDM4E | |
| SCHEMBL24219503 | 0.79 | — | — | |
| SCHEMBL24219375 | 0.77 | PIK3CD (0.39) | PIK3CDKDM4E | |
| SCHEMBL23374610 | 0.77 | PIK3CD (0.39) | PIK3CDKDM4E | |
| SCHEMBL8325794 | 0.76 | PIK3CD (0.43) | PIK3CDHRH3SMN1; SMN2CYP2D6KDM4E | |
| Bromide SCHEMBL28574305 | 0.74 | SMN1; SMN2 (0.41) | HRH3SMN1; SMN2KDM4E | |
| Hydrochloric Acid SCHEMBL29233014 | 0.73 | MAPT (0.52) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL24243286 | 0.73 | OPRD1 (0.38) | HRH3KDM4EALDH1A1 | |
| SCHEMBL21311463 | 0.73 | PIK3CD (0.45) | PIK3CDHRH3SMN1; SMN2CYP2D6KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-3453709-A1 | TETRAHYDROPYRIDOPYRAZINES MODULATORS OF GPR6 | Takeda Pharmaceutical Company Limited (JP) | 2019-03-13 | — | — | EP | disclosed |