Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 11/20 | 0.46 |
| ▸ | MAP3K12 | Q12852 | 7/20 | 0.36 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL626170 | 0.84 | PIK3CA (0.53) | PIK3CAMAP3K12 | |
| SCHEMBL625036 | 0.81 | PIM1 (0.49) | — | |
| SCHEMBL626700 | 0.81 | PIK3CA (0.52) | PIK3CAMAP3K12 | |
| SCHEMBL626888 | 0.79 | AAK1 (0.34) | — | |
| SCHEMBL625674 | 0.77 | PIK3CA (0.50) | PIK3CAMAP3K12 | |
| SCHEMBL626893 | 0.76 | PIK3CA (0.49) | PIK3CA | |
| SCHEMBL626891 | 0.76 | PIK3CA (0.49) | PIK3CA | |
| SCHEMBL625131 | 0.75 | PIK3CA (0.49) | PIK3CARIPK1 | |
| SCHEMBL625434 | 0.75 | PIK3CA (0.50) | PIK3CAMAP3K12 | |
| SCHEMBL624990 | 0.74 | PIK3CA (0.47) | PIK3CARIPK1 |
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 |