Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 10/20 | 0.50 |
| ▸ | MAP3K12 | Q12852 | 8/20 | 0.41 |
| ▸ | FYN | P06241 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL625235 | 0.84 | FYN (0.52) | PIK3CAFYN | |
| SCHEMBL626700 | 0.82 | PIK3CA (0.52) | PIK3CAMAP3K12 | |
| SCHEMBL626701 | 0.82 | MKNK1 (0.52) | PIK3CAFYN | |
| SCHEMBL626170 | 0.79 | PIK3CA (0.53) | PIK3CAMAP3K12FYN | |
| SCHEMBL625653 | 0.79 | PIK3CA (0.54) | PIK3CAMAP3K12 | |
| SCHEMBL624007 | 0.78 | PIM1 (0.51) | FYN | |
| SCHEMBL625325 | 0.77 | FYN (0.55) | FYN | |
| SCHEMBL625189 | 0.77 | PIK3CA (0.46) | PIK3CAMAP3K12 | |
| SCHEMBL626107 | 0.77 | PIK3CA (0.48) | PIK3CAFYN | |
| SCHEMBL625652 | 0.76 | PIK3CA (0.49) | PIK3CAMAP3K12FYN |
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 |