Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19918261 | 0.85 | KDM4E (0.35) | KDM4EALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL5617212 | 0.79 | DAGLA (0.35) | KDM4EALDH1A1 | |
| SCHEMBL20805108 | 0.75 | MEN1 (0.35) | KDM4EALDH1A1 | |
| SCHEMBL5617419 | 0.67 | DAGLA (0.38) | KDM4EALDH1A1 | |
| SCHEMBL9063676 | 0.67 | TSHR (0.32) | — | |
| SCHEMBL23048857 | 0.66 | MEN1 (0.36) | KDM4EALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL16770363 | 0.65 | PSMD14 (0.34) | — | |
| SCHEMBL12800162 | 0.64 | — | — | |
| SCHEMBL2376039 | 0.64 | HSD17B10 (0.39) | KDM4EALDH1A1CYP3A4 | |
| SCHEMBL15259202 | 0.64 | LMNA (0.30) | — |
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-2563791-B1 | A PROCESS OF A QUATERNARY AMMONIUM SALT USING PHOSPHATE | SUMITOMO DAINIPPON PHARMA CO LTD (JP) | 2014-12-24 | — | — | EP | disclosed |