Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 11/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.50 |
| ▸ | XDH | P47989 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 2/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.38 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.38 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.36 |
| ▸ | ATR | Q13535 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3799807 | 0.92 | PTGES (0.43) | PTGESPTGS1MAPK14CYP2C9DGAT1 | |
| SCHEMBL13076280 | 0.87 | PTGES (0.56) | PTGESPTGS1XDHDHODHMAPK14 | |
| SCHEMBL3790737 | 0.86 | PTGES (0.49) | PTGESPTGS1MAPK14CYP2C9 | |
| SCHEMBL3795197 | 0.81 | PTGES (0.47) | PTGESMAPK14CYP2D6CYP2C9 | |
| SCHEMBL3805843 | 0.80 | PTGES (0.46) | PTGESMAPK14CYP2D6CYP2C9 | |
| SCHEMBL3799359 | 0.79 | PTGES (0.44) | PTGESMAPK14CYP2C9 | |
| SCHEMBL13076252 | 0.79 | PTGES (0.57) | PTGESPTGS1MAPK14 | |
| SCHEMBL3793065 | 0.78 | PTGES (0.47) | PTGESMAPK14ATRCYP2C9 | |
| SCHEMBL3795498 | 0.76 | PTGES (0.45) | PTGESMAPK14 | |
| SCHEMBL3796330 | 0.76 | PTGES (0.41) | PTGESMAPK14CYP2D6CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010127152-A2 | COMPOUNDS AND COMPOSITIONS AS MICROSOMAL PROSTAGLANDIN E SYNTHASE-1 INHIBITORS | IRM LLC (BM) | 2010-11-04 | — | — | WO | claimed |
| WO-2010127152-A2 | COMPOUNDS AND COMPOSITIONS AS MICROSOMAL PROSTAGLANDIN E SYNTHASE-1 INHIBITORS | IRM LLC (BM) | 2010-11-04 | — | — | WO | disclosed |