Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.52 |
| ▸ | HPGD | P15428 | 6/20 | 0.52 |
| ▸ | MAPT | P10636 | 5/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 5/20 | 0.39 |
| ▸ | HTR2A | P28223 | 5/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31454933 | 1.00 | ALDH1A1 (0.52) | ALDH1A1HPGDMAPTKDM4EGAA | |
| SCHEMBL31454931 | 0.91 | ALDH1A1 (0.53) | ALDH1A1HPGDMAPTKDM4EGAA | |
| SCHEMBL31454938 | 0.91 | ALDH1A1 (0.47) | ALDH1A1HPGDMAPTKDM4EGAA | |
| SCHEMBL31454887 | 0.90 | ALDH1A1 (0.52) | ALDH1A1HPGDMAPTKDM4EGAA | |
| SCHEMBL31454911 | 0.88 | ALDH1A1 (0.54) | ALDH1A1HPGDMAPTKDM4EGAA | |
| SCHEMBL31454905 | 0.88 | ALDH1A1 (0.61) | ALDH1A1HPGDMAPTKDM4EGAA | |
| Hydrochloric Acid SCHEMBL31454922 | 0.88 | ALDH1A1 (0.54) | ALDH1A1HPGDMAPTKDM4EGAA | |
| SCHEMBL31454879 | 0.87 | KDM4E (0.56) | ALDH1A1HPGDMAPTKDM4EGAA | |
| SCHEMBL31454840 | 0.87 | ALDH1A1 (0.59) | ALDH1A1HPGDMAPTKDM4EGAA | |
| SCHEMBL31454863 | 0.86 | KDM4E (0.52) | ALDH1A1HPGDMAPTKDM4EGAA |
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-2025042896-A1 | DNA TOPOISOMERASE IIβ INHIBITORS | MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) | 2025-02-27 | — | — | WO | disclosed |