Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.54 |
| ▸ | BCHE | P06276 | 2/20 | 0.52 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.49 |
| ▸ | MAOB | P27338 | 2/20 | 0.48 |
| ▸ | FOS | P01100 | 1/20 | 0.48 |
| ▸ | JUN | P05412 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | TTR | P02766 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8569558 | 0.96 | BCHE (0.55) | KMT2ABCHEALOX5KDM4EMEN1 | |
| SCHEMBL8569555 | 0.96 | BCHE (0.55) | KMT2ABCHEALOX5KDM4EMEN1 | |
| SCHEMBL716895 | 0.88 | KMT2A (0.60) | KMT2ABCHEALOX5KDM4EMEN1 | |
| SCHEMBL716894 | 0.88 | KMT2A (0.60) | KMT2ABCHEALOX5KDM4EMEN1 | |
| SCHEMBL1711135 | 0.85 | KDM4E (0.66) | KMT2ABCHEALOX5KDM4EMEN1 | |
| SCHEMBL1711133 | 0.85 | KDM4E (0.66) | KMT2ABCHEALOX5KDM4EMEN1 | |
| SCHEMBL15996560 | 0.83 | JUN (0.57) | KMT2ABCHEALOX5KDM4EMEN1 | |
| SCHEMBL4713551 | 0.81 | BCHE (0.55) | KMT2ABCHEALOX5KDM4EMEN1 | |
| SCHEMBL4713549 | 0.81 | BCHE (0.55) | KMT2ABCHEALOX5KDM4EMEN1 | |
| SCHEMBL719415 | 0.80 | KMT2A (0.73) | KMT2ABCHEKDM4EMEN1GAA |
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-0526642-B1 | TRITERPENE DERIVATIVE | SHIONOGI & CO (JP) | 1998-04-01 | — | — | EP | disclosed |
| US-5248807-A | Endothelin antagonists, treatment of cardiovascular disorders | SHIONOGI & CO., LTD. (JP) | 1993-09-28 | — | — | US | disclosed |
| EP-0526642-A1 | TRITERPENE DERIVATIVE | SHIONOGI SEIYAKU KABUSHIKI KAISHA (JP) | 1993-02-10 | — | — | EP | disclosed |