Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 17/20 | 0.53 |
| ▸ | MAPK3 | P27361 | 3/20 | 0.53 |
| ▸ | MAP2K1 | Q02750 | 2/20 | 0.53 |
| ▸ | IGF1R | P08069 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL22489957 | 0.87 | LRRK2 (0.52) | LRRK2MAPK1MAPK3MAP2K1IGF1R | |
| SCHEMBL29751855 | 0.81 | LRRK2 (0.51) | LRRK2MAPK1MAPK3MAP2K1IGF1R | |
| SCHEMBL16554108 | 0.78 | MAPK1 (0.49) | LRRK2MAPK1MAPK3MAP2K1IGF1R | |
| SCHEMBL17630399 | 0.77 | LRRK2 (0.48) | LRRK2MAPK1MAPK3MAP2K1IGF1R | |
| SCHEMBL29499585 | 0.76 | EGFR (0.52) | LRRK2MAPK1MAPK3MAP2K1IGF1R | |
| SCHEMBL28744881 | 0.76 | EGFR (0.52) | LRRK2MAPK1MAPK3MAP2K1IGF1R | |
| SCHEMBL29730526 | 0.76 | MAPK1 (0.53) | LRRK2MAPK1MAPK3MAP2K1IGF1R | |
| SCHEMBL29704046 | 0.73 | LRRK2 (0.49) | LRRK2MAPK1MAPK3MAP2K1IGF1R | |
| SCHEMBL18765835 | 0.73 | MAPK1 (0.62) | LRRK2MAPK1MAPK3IGF1R | |
| SCHEMBL24650800 | 0.72 | LRRK2 (0.50) | LRRK2MAPK1MAPK3MAP2K1IGF1R |
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-2020228817-A1 | ERK INHIBITOR AND USE THEREOF | 南京明德新药研发有限公司 | 2020-11-19 | — | — | WO | disclosed |