Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 9/20 | 0.52 |
| ▸ | MAP3K12 | Q12852 | 10/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | DLK1 | P80370 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL626636 | 0.90 | PIK3CA (0.54) | PIK3CAMAP3K12 | |
| SCHEMBL626638 | 0.90 | PIK3CA (0.54) | PIK3CAMAP3K12 | |
| SCHEMBL627785 | 0.86 | PIK3CA (0.56) | PIK3CAMAP3K12PIM1 | |
| SCHEMBL627784 | 0.86 | PIK3CA (0.56) | PIK3CAMAP3K12PIM1 | |
| SCHEMBL625653 | 0.86 | PIK3CA (0.54) | PIK3CAMAP3K12 | |
| SCHEMBL625050 | 0.85 | PIK3CA (0.53) | PIK3CAMAP3K12 | |
| SCHEMBL625863 | 0.84 | PIK3CA (0.51) | PIK3CAMAP3K12 | |
| SCHEMBL625282 | 0.84 | MAP3K12 (0.45) | PIK3CAMAP3K12DLK1 | |
| SCHEMBL625635 | 0.83 | PIK3CA (0.51) | PIK3CAPIM1KCNH2 | |
| SCHEMBL624921 | 0.81 | PIK3CA (0.49) | PIK3CAMAP3K12 |
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 |