Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 13/20 | 0.45 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.40 |
| ▸ | TYK2 | P29597 | 3/20 | 0.39 |
| ▸ | BRD4 | O60885 | 2/20 | 0.39 |
| ▸ | TAF1 | P21675 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17969778 | 0.95 | LRRK2 (0.47) | LRRK2ALKBRD4TAF1 | |
| SCHEMBL16615278 | 0.94 | ALK (0.43) | LRRK2ALKBRD4TAF1 | |
| SCHEMBL16615273 | 0.94 | LRRK2 (0.47) | LRRK2ALK | |
| SCHEMBL17918709 | 0.88 | ALK (0.47) | LRRK2ALKTYK2 | |
| SCHEMBL16615271 | 0.86 | ALK (0.39) | LRRK2ALK | |
| SCHEMBL17918793 | 0.84 | LRRK2 (0.44) | LRRK2TYK2 | |
| SCHEMBL17918708 | 0.81 | LRRK2 (0.49) | LRRK2 | |
| SCHEMBL17969758 | 0.80 | EGFR (0.39) | LRRK2ALK | |
| SCHEMBL16615362 | 0.79 | ALK (0.40) | ALK | |
| SCHEMBL16615286 | 0.79 | ALK (0.49) | ALK |
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-2015047133-A1 | NOVEL CHEMICAL COMPOUNDS (VARIANTS) AND THE USE THEREOF TO TREAT ONCOLOGICAL DISEASES | ОБЩЕСТВО С ОГРАНИЧЕННОЙ ОТВЕТСТВЕННОСТЬЮ "ОТЕЧЕСТВЕННЫЕ ФАРМАЦЕВТИЧЕСКИЕ ТЕХНОЛОГИИ" | 2015-04-02 | — | — | WO | disclosed |