Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | USP28 | Q96RU2 | 1/20 | 0.37 |
| ▸ | USP25 | Q9UHP3 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 3/20 | 0.35 |
| ▸ | KCNN3 | Q9UGI6 | 1/20 | 0.35 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | GPR39 | O43194 | 1/20 | 0.33 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | WDR5 | P61964 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | LTA4H | P09960 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 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 | |
|---|---|---|---|---|
| SCHEMBL3392201 | 0.76 | SLC6A4 (0.38) | HDAC6HSP90AA1 | |
| SCHEMBL3392210 | 0.70 | PRMT1 (0.47) | SCN8AHTR2ACHEK1CA12CA1 | |
| SCHEMBL15984865 | 0.70 | TAAR1 (0.44) | CHEK1HSP90AA1 | |
| SCHEMBL8348550 | 0.68 | SCN8A (0.55) | SCN8AEPHX2 | |
| SCHEMBL4575327 | 0.68 | BCHE (0.59) | SCN8ASLC6A5CA1CA2LTA4H | |
| SCHEMBL3396182 | 0.67 | CLK1 (0.57) | HDAC6HDAC1PPARA | |
| Hydrochloric Acid SCHEMBL6122751 | 0.67 | SCN8A (0.54) | SCN8AEPHX2 | |
| SCHEMBL15980807 | 0.67 | LMNA (0.39) | HSP90AA1PPARA | |
| SCHEMBL19243611 | 0.66 | SCN8A (0.55) | SCN8AHDAC6HDAC1EPHX2 | |
| SCHEMBL9903315 | 0.66 | SCN8A (0.58) | SCN8ASLC6A5CA12CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2246329-A1 | 4(1H)-pyridinone derivatives and their use as antimalaria agents | Glaxo Group Limited (GB) | 2010-11-03 | — | — | EP | disclosed |