Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | PTGES | O14684 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6509590 | 0.87 | KDM4E (0.49) | KDM4EHSD17B10GAAPARP1ALDH1A1 | |
| SCHEMBL6505871 | 0.86 | PARP1 (0.45) | MAPK1KDM4EHSD17B10GAAPARP1 | |
| SCHEMBL6504605 | 0.85 | USP2 (0.44) | MAPK1KDM4EHSD17B10GAAHTT | |
| SCHEMBL6504646 | 0.72 | HSD17B10 (0.58) | MAPK1KDM4EHSD17B10HTTALDH1A1 | |
| SCHEMBL6644132 | 0.70 | RAB9A (0.43) | MAPK1KDM4EHSD17B10GAAPARP1 | |
| Hydrochloric Acid SCHEMBL8814898 | 0.69 | GRIN2B (0.59) | MAPK1KDM4EHSD17B10HTTPARP1 | |
| SCHEMBL17554105 | 0.68 | HTT (0.82) | GAAHTTALDH1A1 | |
| SCHEMBL17731555 | 0.67 | IRAK4 (0.56) | KDM4EGAAALDH1A1SMN1; SMN2RAB9A | |
| SCHEMBL6499836 | 0.67 | KDM4E (0.74) | MAPK1KDM4EHSD17B10HTTALDH1A1 | |
| SCHEMBL4105446 | 0.66 | KCNH2 (0.74) | SMN1; SMN2CNR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005021547-A2 | HETEROCYCLIC CANNABINOID CB2 RECEPTOR ANTAGONISTS | PHARMAXIS PTY LTD. (AU) | 2005-03-10 | — | — | WO | disclosed |