Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 3/20 | 0.45 |
| ▸ | MAPK13 | O15264 | 2/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 5/20 | 0.35 |
| ▸ | WNT1 | P04628 | 5/20 | 0.35 |
| ▸ | GSK3B | P49841 | 5/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 5/20 | 0.35 |
| ▸ | HSPB1 | P04792 | 1/20 | 0.34 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.34 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.34 |
| ▸ | RAF1 | P04049 | 1/20 | 0.34 |
| ▸ | BRAF | P15056 | 1/20 | 0.34 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.34 |
| ▸ | AURKA | O14965 | 1/20 | 0.34 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.34 |
| ▸ | AKT1 | P31749 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | CDK1 | P06493 | 2/20 | 0.33 |
| ▸ | CDK2 | P24941 | 2/20 | 0.33 |
| ▸ | SMG1 | Q96Q15 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19672208 | 0.89 | PIK3CA (0.43) | PIK3CAMAPK13MAPK14WNT1GSK3B | |
| SCHEMBL19671935 | 0.89 | PIK3CA (0.43) | PIK3CAMAPK13MAPK14WNT1GSK3B | |
| SCHEMBL19672049 | 0.82 | PIK3CA (0.56) | PIK3CAMAPK13MAPK14RAF1BRAF | |
| SCHEMBL19671895 | 0.82 | PIK3CA (0.43) | PIK3CAMAPK13MAPK14WNT1GSK3B | |
| SCHEMBL22890671 | 0.81 | PIK3CA (0.54) | PIK3CAMAPK13MAPK14WNT1GSK3B | |
| SCHEMBL19672031 | 0.81 | PIK3CA (0.45) | PIK3CAMAPK13MAPK14WNT1GSK3B | |
| SCHEMBL19672156 | 0.80 | PIK3CA (0.46) | PIK3CAMAPK13MAPK14WNT1GSK3B | |
| SCHEMBL19671689 | 0.80 | PIK3CA (0.46) | PIK3CAMAPK13MAPK14WNT1GSK3B | |
| SCHEMBL19671826 | 0.80 | PIK3CA (0.53) | PIK3CAMAPK13MAPK14WNT1GSK3B | |
| SCHEMBL19672122 | 0.80 | PIK3CA (0.42) | PIK3CAMAPK13MAPK14WNT1GSK3B |
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-2964221-B1 | COMPOUNDS INHIBITING LEUCINE-RICH REPEAT KINASE ENZYME ACTIVITY | MERCK SHARP & DOHME (US) | 2017-12-06 | — | — | EP | disclosed |