Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 15/20 | 0.42 |
| ▸ | CCNE1 | P24864 | 11/20 | 0.42 |
| ▸ | MAP3K12 | Q12852 | 1/20 | 0.41 |
| ▸ | CCND1 | P24385 | 11/20 | 0.41 |
| ▸ | CDK6 | Q00534 | 7/20 | 0.41 |
| ▸ | CDK1 | P06493 | 11/20 | 0.40 |
| ▸ | CDK4 | P11802 | 10/20 | 0.40 |
| ▸ | CCNB1 | P14635 | 7/20 | 0.40 |
| ▸ | CCND3 | P30281 | 6/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 4/20 | 0.39 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.39 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL626188 | 0.91 | MAP3K12 (0.41) | CDK2CCNE1MAP3K12CCND1CDK6 | |
| SCHEMBL625109 | 0.89 | CDK2 (0.46) | CDK2CCNE1MAP3K12CCND1CDK6 | |
| SCHEMBL626206 | 0.86 | PIK3CA (0.53) | MAP3K12PIK3CA | |
| SCHEMBL626189 | 0.86 | MAP3K12 (0.42) | CDK2CCNE1MAP3K12CCND1CDK6 | |
| SCHEMBL626207 | 0.83 | MAP3K12 (0.46) | CDK2CCNE1MAP3K12CCND1CDK6 | |
| SCHEMBL625753 | 0.78 | PIK3CA (0.49) | MAP3K12PIK3CA | |
| SCHEMBL627466 | 0.76 | HASPIN (0.43) | MAP3K12PIK3CAPIK3CDPIK3CBPIK3CG | |
| SCHEMBL627468 | 0.76 | HASPIN (0.43) | MAP3K12PIK3CAPIK3CDPIK3CBPIK3CG | |
| SCHEMBL627323 | 0.75 | FYN (0.48) | MAP3K12PIK3CAPIK3CDPIK3CBPIK3CG | |
| SCHEMBL627321 | 0.75 | FYN (0.48) | MAP3K12PIK3CAPIK3CDPIK3CBPIK3CG |
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 |