Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 14/20 | 0.58 |
| ▸ | PTGS1 | P23219 | 6/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | CDC7 | O00311 | 1/20 | 0.44 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.41 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.41 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.41 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CSNK1A1L | Q8N752 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 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 | |
|---|---|---|---|---|
| SCHEMBL30879827 | 0.91 | PTGS2 (0.54) | PTGS2PTGS1ALDH1A1HPGDCDC7 | |
| SCHEMBL18161744 | 0.89 | PTGS2 (0.58) | PTGS2PTGS1ALDH1A1HPGDMAPK14 | |
| SCHEMBL14692607 | 0.87 | PTGS2 (0.59) | PTGS2PTGS1ALDH1A1HPGDMAPK14 | |
| SCHEMBL14692454 | 0.84 | PTGS2 (0.59) | PTGS2PTGS1ALDH1A1HPGDMAPK14 | |
| SCHEMBL22068721 | 0.72 | PTGS1 (0.78) | PTGS2PTGS1ALDH1A1HPGDMAPK14 | |
| SCHEMBL3120716 | 0.72 | MAPK13 (0.57) | PTGS2ALDH1A1HPGDCDC7MAPK14 | |
| SCHEMBL4467134 | 0.71 | MAPK14 (0.63) | PTGS2PTGS1MAPK14GSK3B | |
| SCHEMBL14692202 | 0.70 | PTGS2 (0.63) | PTGS2PTGS1ALDH1A1HPGDMAPK14 | |
| SCHEMBL30879817 | 0.69 | MAPK14 (0.51) | PTGS2PTGS1MAPK14MAPK11GSK3B | |
| SCHEMBL30879822 | 0.66 | CDC7 (0.38) | PTGS2PTGS1ALDH1A1CDC7MAPK14 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2739143-B1 | PREPARATION AND METHODS OF USE FOR ORTHO-ARYL 5- MEMBERED HETEROARYL-CARBOXAMIDE CONTAINING MULTI-TARGETED KINASE INHIBITORS | FLYNN GARY A (US) | 2018-07-11 | — | — | EP | disclosed |