Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 2/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 10/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL16795129 | 0.82 | MAOB (0.36) | ALDH1A1GAAMAPTDRD2MAOB | |
| SCHEMBL27032333 | 0.77 | KDM4E (0.39) | ALDH1A1MAPTMAOB | |
| SCHEMBL29925545 | 0.77 | KDM4E (0.39) | ALDH1A1MAPTMAOB | |
| SCHEMBL16795221 | 0.76 | HRH3 (0.40) | HRH3 | |
| SCHEMBL16795206 | 0.73 | KCNH2 (0.49) | ALDH1A1GAAMAPTDRD2OPRM1 | |
| SCHEMBL30123801 | 0.71 | DRD2 (0.54) | DRD2KCNH2 | |
| SCHEMBL21296522 | 0.70 | KDM4E (0.51) | GAADRD2KCNH2 | |
| SCHEMBL18621693 | 0.70 | DRD2 (0.45) | DRD2OPRM1KCNH2 | |
| SCHEMBL15884649 | 0.69 | FFAR1 (0.51) | ALDH1A1HRH3KCNH2 | |
| SCHEMBL14158883 | 0.69 | LPL (0.41) | ALDH1A1MAPTMAOB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015086693-A1 | PYRAZOLOPYRIMIDIN-2-YL DERIVATIVES AS JAK INHIBITORS | ALMIRALL, S.A. (ES) | 2015-06-18 | — | — | WO | disclosed |