Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 4/20 | 0.46 |
| ▸ | HPGDS | O60760 | 5/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 4/20 | 0.36 |
| ▸ | CNR2 | P34972 | 4/20 | 0.36 |
| ▸ | QPCT | Q16769 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3800503 | 0.93 | PTGES (0.49) | PTGESHPGDSNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL13076253 | 0.87 | NPC1 (0.38) | PTGESNPC1RAB9ASMN1; SMN2CNR1 | |
| SCHEMBL3797347 | 0.87 | PTGES (0.50) | PTGESHPGDSNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL3793690 | 0.83 | PTGES (0.46) | PTGESHPGDSNPC1RAB9AJAK2 | |
| SCHEMBL3790517 | 0.82 | PTGES (0.54) | PTGESHPGDSNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL13076255 | 0.80 | NPC1 (0.46) | PTGESNPC1RAB9ASMN1; SMN2QPCT | |
| SCHEMBL3802070 | 0.79 | PTGES (0.49) | PTGESHPGDSNPC1RAB9AJAK2 | |
| SCHEMBL3794424 | 0.78 | PTGES (0.47) | PTGESHPGDSNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL3797930 | 0.77 | PTGES (0.46) | PTGESHPGDSNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL3799989 | 0.76 | PTGES (0.44) | PTGESHPGDSNPC1RAB9AJAK2 |
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 |