Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 18/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13386000 | 0.90 | PDPK1 (0.49) | PDPK1MAPK1 | |
| SCHEMBL1915403 | 0.90 | PDPK1 (0.49) | PDPK1MAPK1 | |
| SCHEMBL1915569 | 0.90 | PDPK1 (0.49) | PDPK1MAPK1 | |
| SCHEMBL12531468 | 0.89 | PDPK1 (0.53) | PDPK1MAPK1 | |
| SCHEMBL1915631 | 0.89 | PDPK1 (0.53) | PDPK1MAPK1 | |
| SCHEMBL1916381 | 0.89 | PDPK1 (0.53) | PDPK1MAPK1 | |
| SCHEMBL1915528 | 0.86 | PDPK1 (0.49) | PDPK1MAPK1 | |
| SCHEMBL1915345 | 0.86 | PDPK1 (0.49) | PDPK1MAPK1 | |
| SCHEMBL1915649 | 0.82 | PDPK1 (0.58) | PDPK1MAPK1 | |
| SCHEMBL12530668 | 0.81 | PDPK1 (0.67) | PDPK1ALK |
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-2011076327-A1 | PYRROLO[2,3-D]PYRAZIN-7-YL PYRIMIDINE COMPOUNDS | MERCK PATENT GMBH (DE) | 2011-06-30 | — | — | WO | disclosed |