Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K12 | Q12852 | 17/20 | 0.49 |
| ▸ | MTOR | P42345 | 2/20 | 0.44 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.44 |
| ▸ | DHFR | P00374 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3413852 | 0.82 | MAP3K12 (0.47) | MAP3K12 | |
| SCHEMBL17076880 | 0.76 | MAPT (0.42) | MAP3K12MTORPIK3CA | |
| SCHEMBL3432392 | 0.71 | MAP3K12 (0.52) | MAP3K12MTORPIK3CA | |
| SCHEMBL3432395 | 0.71 | MAP3K12 (0.52) | MAP3K12 | |
| SCHEMBL16216907 | 0.68 | MAP3K12 (0.78) | MAP3K12 | |
| SCHEMBL16216908 | 0.68 | MAP3K12 (0.78) | MAP3K12 | |
| SCHEMBL4276690 | 0.66 | STK17A (0.48) | MAP3K12 | |
| SCHEMBL16210488 | 0.66 | MAP3K12 (1.00) | MAP3K12 | |
| SCHEMBL21658972 | 0.66 | MAP3K12 (0.48) | MAP3K12MTORPIK3CA | |
| SCHEMBL21658973 | 0.66 | MAP3K12 (0.48) | MAP3K12 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2558474-A1 | 2, 4-PYRIMIDINEDIAMINE COMPOUNDS AND PRODRUGS THEREOF AND THEIR USES | Rigel Pharmaceuticals, Inc. (US) | 2013-02-20 | — | — | EP | claimed |
| WO-2011130390-A1 | 2, 4-PYRIMIDINEDIAMINE COMPOUNDS AND PRODRUGS THEREOF AND THEIR USES | RIGEL PHARMACEUTICALS, INC. (US) | 2011-10-20 | — | — | WO | claimed |