Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 7/20 | 0.44 |
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 4/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.38 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | ZAP70 | P43403 | 1/20 | 0.35 |
| ▸ | SYK | P43405 | 1/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.35 |
| ▸ | MTOR | P42345 | 2/20 | 0.35 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.35 |
| ▸ | RAF1 | P04049 | 1/20 | 0.35 |
| ▸ | BRAF | P15056 | 1/20 | 0.35 |
| ▸ | JAK3 | P52333 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL16211956 | 0.83 | CNR2 (0.52) | CNR2 | |
| SCHEMBL16211738 | 0.80 | CNR2 (0.70) | CNR2 | |
| SCHEMBL16211686 | 0.79 | CNR2 (0.54) | CNR2 | |
| SCHEMBL16222478 | 0.79 | CNR2 (0.58) | CNR2 | |
| SCHEMBL20171935 | 0.78 | MAPK1 (0.43) | LRRK2CHEK1MAPK1PDPK1PAK1 | |
| SCHEMBL14071958 | 0.77 | MAP2K7 (0.45) | LRRK2CHEK1MAPK1PDPK1PAK1 | |
| SCHEMBL8826341 | 0.74 | IKBKB (0.52) | LRRK2CHEK1MAPK1PDPK1PAK1 | |
| SCHEMBL30253959 | 0.74 | CHEK1 (0.44) | LRRK2CHEK1MAPK1PDPK1PAK1 | |
| SCHEMBL336113 | 0.74 | CHEK1 (0.44) | LRRK2CHEK1MAPK1PDPK1PAK1 | |
| SCHEMBL19414424 | 0.74 | CHEK1 (0.44) | CHEK1MAPK1PDPK1PAK1PIK3CA |
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-2991987-B1 | PURINE DERIVATIVES AS CB2 RECEPTOR AGONISTS | HOFFMANN LA ROCHE (CH) | 2018-05-23 | — | — | EP | disclosed |