Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 4/20 | 0.42 |
| ▸ | STK4 | Q13043 | 3/20 | 0.42 |
| ▸ | STK3 | Q13188 | 3/20 | 0.42 |
| ▸ | EGFR | P00533 | 3/20 | 0.41 |
| ▸ | BRAF | P15056 | 4/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | TNNI3K | Q59H18 | 3/20 | 0.38 |
| ▸ | TTK | P33981 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | CDK1 | P06493 | 2/20 | 0.37 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | PRKCA | P17252 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9980404 | 0.84 | STK4 (0.39) | LRRK2STK4STK3EGFRBRAF | |
| SCHEMBL12065785 | 0.79 | BRAF (0.67) | LRRK2STK4STK3BRAFTNNI3K | |
| SCHEMBL30295802 | 0.75 | LRRK2 (0.67) | LRRK2STK4STK3CNR2 | |
| SCHEMBL9980486 | 0.74 | FFAR2 (0.33) | LRRK2ALDH1A1CA1CA2 | |
| SCHEMBL9980436 | 0.73 | TNNI3K (0.37) | EGFRBRAFTNNI3KCA12CA1 | |
| SCHEMBL9980493 | 0.72 | TNNI3K (0.36) | LRRK2EGFRBRAFTNNI3KALDH1A1 | |
| SCHEMBL1809126 | 0.71 | SRC (0.43) | EGFRBRAFTNNI3KSRC | |
| SCHEMBL2225236 | 0.71 | TNNI3K (0.51) | EGFRCDK2TNNI3KCDK1CA12 | |
| SCHEMBL9980391 | 0.70 | EGFR (0.41) | EGFRBRAFTNNI3KSRCALDH1A1 | |
| SCHEMBL9980424 | 0.70 | TNNI3K (0.35) | LRRK2EGFRBRAFTNNI3KCA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011149827-A1 | COMPOUNDS AND METHODS | GLAXOSMITHKLINE LLC (US) | 2011-12-01 | — | — | WO | claimed |
| WO-2011149827-A1 | COMPOUNDS AND METHODS | GLAXOSMITHKLINE LLC (US) | 2011-12-01 | — | — | WO | disclosed |