Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 2/20 | 0.43 |
| ▸ | F10 | P00742 | 11/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | JAK1 | P23458 | 1/20 | 0.36 |
| ▸ | TYK2 | P29597 | 1/20 | 0.36 |
| ▸ | JAK3 | P52333 | 1/20 | 0.36 |
| ▸ | CMA1 | P23946 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.35 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3551807 | 0.89 | PIK3CD (0.50) | PIK3CDF10PIK3CAPIK3CGPTGS2 | |
| Trifluoroacetic Acid SCHEMBL4638725 | 0.88 | PIK3CD (0.42) | PIK3CDF10PIK3CAPIK3CGJAK2 | |
| SCHEMBL4638729 | 0.81 | F10 (0.45) | PIK3CDF10 | |
| SCHEMBL4639953 | 0.79 | PIK3CD (0.46) | PIK3CDF10JAK2JAK1TYK2 | |
| SCHEMBL991941 | 0.73 | F10 (0.51) | PIK3CDF10PIK3CAPIK3CGPTGS2 | |
| SCHEMBL31347248 | 0.73 | F10 (0.48) | PIK3CDF10PIK3CAPIK3CGJAK2 | |
| SCHEMBL1028503 | 0.73 | F10 (0.48) | PIK3CDF10PIK3CAPIK3CGJAK2 | |
| SCHEMBL19178457 | 0.73 | F10 (0.51) | PIK3CDF10PIK3CAPIK3CGPTGS2 | |
| SCHEMBL3547660 | 0.72 | PIK3CD (0.44) | PIK3CDF10PTGS2HTR1A | |
| SCHEMBL24195918 | 0.70 | F10 (0.48) | PIK3CDF10PIK3CAPIK3CGJAK2 |
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-1951717-A1 | NOVEL PYRROLIDINE DERIVATIVES AS INHIBITORS OF COAGULATION FACTOR XA | F.HOFFMANN-LA ROCHE AG (CH) | 2008-08-06 | — | — | EP | disclosed |
| WO-2007057317-A1 | NOVEL PYRROLIDINE DERIVATIVES AS INHIBITORS OF COAGULATION FACTOR XA | F. HOFFMANN-LA ROCHE AG (CH) | 2007-05-24 | — | — | WO | disclosed |