Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 8/20 | 0.36 |
| ▸ | PRKDC | P78527 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.32 |
| ▸ | MAP3K12 | Q12852 | 4/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | MAP4K1 | Q92918 | 2/20 | 0.31 |
| ▸ | AXL | P30530 | 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 | |
|---|---|---|---|---|
| SCHEMBL5021286 | 0.89 | LRRK2 (0.37) | LRRK2PRKDCKAT2BMAP3K12AXL | |
| SCHEMBL9930523 | 0.89 | LRRK2 (0.37) | LRRK2PRKDCKAT2BMAP3K12AXL | |
| SCHEMBL17076721 | 0.89 | LRRK2 (0.37) | LRRK2PRKDCKAT2BMAP3K12AXL | |
| SCHEMBL9930425 | 0.89 | LRRK2 (0.41) | LRRK2PRKDCKCNH2KAT2BMAP3K12 | |
| SCHEMBL5021287 | 0.89 | LRRK2 (0.41) | LRRK2PRKDCKCNH2KAT2BMAP3K12 | |
| SCHEMBL17076787 | 0.89 | LRRK2 (0.41) | LRRK2PRKDCKCNH2KAT2BMAP3K12 | |
| SCHEMBL16975520 | 0.81 | KAT2B (0.43) | LRRK2KCNH2KAT2BMAP3K12ALOX15 | |
| SCHEMBL16975519 | 0.81 | KAT2B (0.43) | LRRK2KCNH2KAT2BMAP3K12ALOX15 | |
| SCHEMBL16975536 | 0.81 | KAT2B (0.43) | LRRK2KCNH2KAT2BMAP3K12ALOX15 | |
| SCHEMBL15649834 | 0.81 | KAT2B (0.36) | LRRK2KAT2BMAP3K12 |
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-2638031-A1 | PYRAZOLE AMINOPYRIMIDINE DERIVATIVES AS LRRK2 MODULATORS | F.HOFFMANN-LA ROCHE AG (CH) | 2013-09-18 | — | — | EP | disclosed |
| WO-2012062783-A1 | PYRAZOLE AMINOPYRIMIDINE DERIVATIVES AS LRRK2 MODULATORS | F. HOFFMANN-LA ROCHE AG (CH) | 2012-05-18 | — | — | WO | disclosed |