Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL8128347 | 0.89 | HTT (0.43) | HTTSMN1; SMN2MEN1ALDH1A1KMT2A | |
| SCHEMBL8118001 | 0.88 | HTT (0.50) | HTTSMN1; SMN2MEN1ALDH1A1KMT2A | |
| SCHEMBL8119700 | 0.87 | HTT (0.44) | HTTSMN1; SMN2MEN1ALDH1A1KMT2A | |
| SCHEMBL8119210 | 0.86 | APP (0.40) | HTTSMN1; SMN2MAOBKDM4ETP53 | |
| SCHEMBL8120463 | 0.77 | TTPA (0.48) | HTTSMN1; SMN2MEN1ALDH1A1KMT2A | |
| SCHEMBL8136363 | 0.74 | APP (0.37) | HTTSMN1; SMN2MAOBKDM4ETP53 | |
| SCHEMBL9204952 | 0.72 | PTPN1 (0.40) | HTTALDH1A1HPGD | |
| SCHEMBL8126095 | 0.72 | ACHE (0.48) | HTTSMN1; SMN2MEN1ALDH1A1KMT2A | |
| SCHEMBL8665739 | 0.71 | HTT (0.61) | HTTSMN1; SMN2MEN1ALDH1A1KMT2A | |
| SCHEMBL8127195 | 0.70 | KDM4E (0.40) | HTTSMN1; SMN2MAOBKDM4ETP53 |
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-1006108-A1 | 3-Hydroxy-2(1H)-pyridinone or 3-hydroxy-4(1H)-pyridinone derivatives useful as reactive oxygen species (ROS) scavengers | Cerebrus Pharmaceuticals Limited (GB) | 2000-06-07 | — | — | EP | disclosed |