Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 18/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | JAK1 | P23458 | 1/20 | 0.35 |
| ▸ | JAK3 | P52333 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5021214 | 0.86 | MAPK1 (0.54) | LRRK2CYP1A2MAPK1JAK1 | |
| SCHEMBL4562320 | 0.85 | LRRK2 (0.58) | LRRK2CYP1A2 | |
| SCHEMBL4560390 | 0.83 | LRRK2 (0.56) | LRRK2CYP1A2JAK1 | |
| SCHEMBL5020937 | 0.80 | LRRK2 (0.52) | LRRK2CYP1A2MAPK1 | |
| SCHEMBL5020931 | 0.79 | LRRK2 (0.57) | LRRK2CYP1A2MAPK1 | |
| SCHEMBL4559419 | 0.76 | LRRK2 (0.69) | LRRK2CYP1A2JAK2 | |
| SCHEMBL4561121 | 0.76 | LRRK2 (0.65) | LRRK2CYP1A2 | |
| SCHEMBL5020936 | 0.75 | LRRK2 (0.61) | LRRK2CYP1A2MAPK1 | |
| SCHEMBL10286426 | 0.75 | LRRK2 (0.62) | LRRK2CYP1A2 | |
| SCHEMBL5021357 | 0.73 | LRRK2 (1.00) | LRRK2CYP1A2 |
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-2012062783-A1 | PYRAZOLE AMINOPYRIMIDINE DERIVATIVES AS LRRK2 MODULATORS | F. HOFFMANN-LA ROCHE AG (CH) | 2012-05-18 | — | — | WO | disclosed |