Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 12/20 | 0.47 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.38 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.38 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | TYK2 | P29597 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 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 | |
|---|---|---|---|---|
| SCHEMBL3793065 | 0.91 | PTGES (0.47) | PTGESMAPK14JAK2TYK2CYP2C9 | |
| SCHEMBL13075515 | 0.87 | PTGES (0.64) | PTGESGABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL3790737 | 0.84 | PTGES (0.49) | PTGESKDM1AMAPK14CYP2C9 | |
| SCHEMBL3798464 | 0.81 | PTGES (0.50) | PTGESMAPK14CYP2C9CYP2D6 | |
| SCHEMBL3799359 | 0.80 | PTGES (0.44) | PTGESKDM1AMAPK14CYP2C9 | |
| SCHEMBL3805843 | 0.80 | PTGES (0.46) | PTGESMAPK14JAK2CYP2C9CYP2D6 | |
| SCHEMBL3799807 | 0.78 | PTGES (0.43) | PTGESMAPK14JAK2CYP2C9 | |
| SCHEMBL13075554 | 0.78 | PTGES (0.64) | PTGESMAPK14JAK2 | |
| SCHEMBL3796330 | 0.77 | PTGES (0.41) | PTGESMAPK14JAK2CYP2C9CYP2D6 | |
| SCHEMBL3795498 | 0.77 | PTGES (0.45) | PTGESMAPK14JAK2 |
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 |