Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 9/20 | 0.49 |
| ▸ | PIM1 | P11309 | 3/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | MAP3K12 | Q12852 | 4/20 | 0.38 |
| ▸ | BMPR1B | O00238 | 4/20 | 0.36 |
| ▸ | BMPR1A | P36894 | 4/20 | 0.36 |
| ▸ | TGFBR1 | P36897 | 4/20 | 0.36 |
| ▸ | ACVRL1 | P37023 | 4/20 | 0.36 |
| ▸ | ACVR1 | Q04771 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL625652 | 0.86 | PIK3CA (0.49) | PIK3CAMAP3K12 | |
| SCHEMBL625635 | 0.85 | PIK3CA (0.51) | PIK3CAPIM1KCNH2 | |
| SCHEMBL625862 | 0.84 | PIK3CA (0.47) | PIK3CAPIM1MAP3K12 | |
| SCHEMBL626133 | 0.83 | PIK3CA (0.47) | PIK3CAMAP3K12 | |
| SCHEMBL624920 | 0.82 | PIK3CA (0.46) | PIK3CA | |
| SCHEMBL625281 | 0.80 | PIK3CA (0.52) | PIK3CAPIM1KCNH2MAP3K12 | |
| SCHEMBL625008 | 0.76 | PIM1 (0.35) | PIM1KCNH2BMPR1BBMPR1ATGFBR1 | |
| SCHEMBL625467 | 0.72 | PIK3CA (0.48) | PIK3CA | |
| SCHEMBL627439 | 0.72 | FYN (0.63) | PIK3CA | |
| SCHEMBL626638 | 0.72 | PIK3CA (0.54) | 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 |