Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 10/20 | 0.55 |
| ▸ | SMG1 | Q96Q15 | 3/20 | 0.54 |
| ▸ | CDK1 | P06493 | 1/20 | 0.54 |
| ▸ | CDK2 | P24941 | 1/20 | 0.54 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.52 |
| ▸ | WNT3A | P56704 | 1/20 | 0.49 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.49 |
| ▸ | ABL1 | P00519 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | SMO | Q99835 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL15317749 | 0.85 | ABL1 (0.51) | LRRK2SMG1CDK1CDK2PIK3CA | |
| SCHEMBL19998635 | 0.84 | LRRK2 (0.48) | LRRK2SMG1CDK1CDK2PIK3CA | |
| SCHEMBL20008239 | 0.84 | BRAF (0.58) | LRRK2SMG1CDK1CDK2PIK3CD | |
| SCHEMBL827848 | 0.83 | PIK3CA (0.58) | LRRK2SMG1CDK1CDK2PIK3CA | |
| SCHEMBL24512294 | 0.81 | LRRK2 (0.46) | LRRK2SMG1CDK1CDK2PIK3CA | |
| SCHEMBL19998588 | 0.80 | USP30 (0.54) | LRRK2SMG1CDK1CDK2PIK3CA | |
| SCHEMBL12864090 | 0.79 | CNR2 (0.62) | CYP2C19 | |
| SCHEMBL16025875 | 0.79 | LRRK2 (0.74) | LRRK2 | |
| SCHEMBL25666539 | 0.79 | ABL1 (0.74) | LRRK2ABL1CYP2C19 | |
| SCHEMBL3995999 | 0.78 | LRRK2 (0.52) | LRRK2SMG1PIK3CACYP2C19 |
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-2655357-B1 | INDAZOLYL TRIAZOLE DERIVATIVES AS IRAK INHIBITORS | MERCK SERONO SA (CH) | 2016-06-22 | — | — | EP | disclosed |