Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | NPC1 | O15118 | 3/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.51 |
| ▸ | DRD3 | P35462 | 1/20 | 0.51 |
| ▸ | AGXT | P21549 | 2/20 | 0.50 |
| ▸ | PPARG | P37231 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | PPARA | Q07869 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL1859481 | 0.85 | TDP1 (0.76) | KDM4ETDP1MAPK1NPC1RAB9A | |
| SCHEMBL29429997 | 0.85 | TDP1 (0.76) | KDM4ETDP1MAPK1NPC1RAB9A | |
| SCHEMBL8565990 | 0.81 | TDP1 (0.76) | KDM4ETDP1MAPK1NPC1RAB9A | |
| SCHEMBL15868577 | 0.81 | KDM4E (0.59) | KDM4ETDP1MAPK1NPC1RAB9A | |
| SCHEMBL470925 | 0.80 | TDP1 (0.68) | KDM4ETDP1MAPK1NPC1RAB9A | |
| SCHEMBL29666114 | 0.80 | TDP1 (0.68) | KDM4ETDP1MAPK1NPC1RAB9A | |
| SCHEMBL9808305 | 0.80 | TDP1 (0.68) | KDM4ETDP1MAPK1NPC1RAB9A | |
| SCHEMBL16902856 | 0.79 | TDP1 (0.73) | KDM4ETDP1MAPK1NPC1RAB9A | |
| SCHEMBL16902857 | 0.79 | TDP1 (0.73) | KDM4ETDP1MAPK1NPC1RAB9A | |
| SCHEMBL16902859 | 0.79 | TDP1 (0.73) | KDM4ETDP1MAPK1NPC1RAB9A |
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-2012033374-A2 | SULPHONATE PRECURSOR HAVING A 1,2,3-TRIAZOLIUM SALT, A PRODUCTION METHOD THEREFOR AND AN INTRAMOLECULAR NUCLEOPHILIC FLUORINATION REACTION USING THE SAME | 서강대학교 산학협력단 (KR) | 2012-03-15 | — | — | WO | disclosed |