Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 9/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.42 |
| ▸ | MAP3K12 | Q12852 | 3/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | KHK | P50053 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL625201 | 0.92 | PIK3CA (0.48) | PIK3CAKCNH2MAP3K12 | |
| SCHEMBL625018 | 0.87 | PIK3CA (0.51) | PIK3CAKCNH2 | |
| SCHEMBL626392 | 0.86 | MAP3K12 (0.44) | MAP3K12KHK | |
| SCHEMBL625222 | 0.86 | PIK3CA (0.48) | PIK3CAKCNH2 | |
| SCHEMBL625432 | 0.85 | PIK3CA (0.50) | PIK3CAKCNH2MAP3K12 | |
| SCHEMBL625227 | 0.83 | PIK3CA (0.55) | PIK3CAKCNH2MAP3K12 | |
| SCHEMBL625177 | 0.83 | PIK3CA (0.49) | PIK3CAKCNH2 | |
| SCHEMBL624865 | 0.83 | PIK3CA (0.49) | PIK3CAKCNH2 | |
| SCHEMBL624633 | 0.82 | PIK3CA (0.47) | PIK3CAKCNH2 | |
| SCHEMBL624411 | 0.82 | PIK3CA (0.54) | PIK3CAKCNH2 |
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 |