Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 3/20 | 0.47 |
| ▸ | CNR2 | P34972 | 3/20 | 0.47 |
| ▸ | LRRK2 | Q5S007 | 6/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | MET | P08581 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | AURKA | O14965 | 1/20 | 0.42 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.42 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | CASP3 | P42574 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL165714 | 0.94 | LRRK2 (0.53) | CNR1CNR2LRRK2CYP3A4CYP2D6 | |
| SCHEMBL10193684 | 0.89 | LRRK2 (0.58) | LRRK2CYP3A4MET | |
| SCHEMBL15204962 | 0.87 | LRRK2 (0.55) | LRRK2METAURKBNPC1MAPT | |
| SCHEMBL257050 | 0.85 | LRRK2 (0.51) | LRRK2CYP3A4METAURKB | |
| SCHEMBL256246 | 0.83 | LRRK2 (0.67) | LRRK2CYP3A4MET | |
| SCHEMBL176196 | 0.83 | LRRK2 (0.68) | LRRK2MET | |
| SCHEMBL168574 | 0.82 | MET (0.51) | LRRK2CYP3A4METAURKAAURKB | |
| SCHEMBL257185 | 0.81 | LRRK2 (0.61) | LRRK2CYP3A4 | |
| SCHEMBL176062 | 0.80 | LRRK2 (0.54) | LRRK2CYP3A4 | |
| SCHEMBL175796 | 0.80 | LRRK2 (0.68) | LRRK2MET |
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-2012028629-A1 | 2 - (BENZYLOXY) BENZAMIDES AS LRRK2 KINASE INHIBITORS | GLAXO GROUP LIMITED (GB) | 2012-03-08 | — | — | WO | disclosed |