Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FYN | P06241 | 5/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL625118 | 0.79 | POLB (0.31) | POLBMAPTMAPK1 | |
| SCHEMBL625117 | 0.77 | FYN (0.42) | FYN | |
| SCHEMBL625468 | 0.69 | MAP3K12 (0.42) | — | |
| SCHEMBL626101 | 0.69 | GPX4 (0.31) | — | |
| SCHEMBL1694466 | 0.66 | MALT1 (0.44) | FYNALDH1A1 | |
| SCHEMBL1373679 | 0.64 | PKM (0.34) | ALDH1A1POLBMAPK1 | |
| SCHEMBL6469371 | 0.62 | PKM (0.32) | — | |
| SCHEMBL20944618 | 0.61 | DDB1 (0.49) | L3MBTL1MAPT | |
| SCHEMBL628244 | 0.60 | MAPK1 (0.36) | FYNMAPK1 | |
| SCHEMBL612330 | 0.60 | ALDH1A1 (0.45) | ALDH1A1L3MBTL1POLBMAPT |
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-2012020215-A1 | AMINO- IMIDAZOLOTHIADIAZOLES FOR USE AS PROTEIN OR LIPID KINASE INHIBITORS | CENTRO NACIONAL DE INVESTIGACIONES ONCOLÓGICAS (CNIO) (ES) | 2012-02-16 | — | — | WO | disclosed |