Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.34 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.33 |
| ▸ | GNRHR | P30968 | 1/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.32 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | FASN | P49327 | 1/20 | 0.32 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | TNKS | O95271 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.32 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3713843 | 0.96 | GRM2 (0.37) | EPHX2GRM2FAAHGRIN1ADORA2B | |
| Trifluoroacetic Acid SCHEMBL3390721 | 0.91 | EPHX2 (0.36) | EPHX2GRM2GRIN1ADORA2BCYP2C9 | |
| SCHEMBL3715589 | 0.86 | GRM2 (0.37) | EPHX2GRM2GRIN1ADORA2B | |
| Hydrochloric Acid SCHEMBL3395503 | 0.86 | GRM2 (0.37) | EPHX2GRM2GRIN1ADORA2B | |
| SCHEMBL3392283 | 0.84 | EPHX2 (0.36) | EPHX2GRM2FAAHADORA2BGNRHR | |
| SCHEMBL13070089 | 0.76 | GRM2 (0.46) | EPHX2GRM2 | |
| SCHEMBL3398512 | 0.76 | GRIN1 (0.40) | GRIN1PARP1 | |
| Hydrochloric Acid SCHEMBL3391883 | 0.76 | GRM2 (0.45) | EPHX2GRM2 | |
| SCHEMBL3391552 | 0.76 | GRM2 (0.45) | GRM2 | |
| Hydrochloric Acid SCHEMBL3394215 | 0.75 | GRM2 (0.45) | EPHX2GRM2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2246329-A1 | 4(1H)-pyridinone derivatives and their use as antimalaria agents | Glaxo Group Limited (GB) | 2010-11-03 | — | — | EP | claimed |
| EP-2246329-A1 | 4(1H)-pyridinone derivatives and their use as antimalaria agents | Glaxo Group Limited (GB) | 2010-11-03 | — | — | EP | disclosed |
| WO-2010081904-A1 | 4 ( 1H) -PYRIDINONE DERIVATIVES AND THEIR USE AS ANTIMALARIA AGENTS | GLAXO GROUP LIMITED (GB) | 2010-07-22 | — | — | WO | disclosed |