Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | CDC25B | P30305 | 2/20 | 0.45 |
| ▸ | PTPRC | P08575 | 1/20 | 0.45 |
| ▸ | PTPRF | P10586 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | CDC25A | P30304 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9777967 | 0.82 | ALDH1A1 (0.47) | MAPK1GAAALDH1A1MAPTKMT2A | |
| SCHEMBL29236536 | 0.81 | ALDH1A1 (0.51) | MAPK1ALDH1A1MAPTLMNAKMT2A | |
| SCHEMBL29236534 | 0.81 | ALDH1A1 (0.51) | MAPK1ALDH1A1MAPTLMNAKMT2A | |
| SCHEMBL29236538 | 0.80 | RPS6KA2 (0.52) | MAPK1SMN1; SMN2ALDH1A1MAPTLMNA | |
| SCHEMBL29236539 | 0.80 | RPS6KA2 (0.52) | MAPK1SMN1; SMN2ALDH1A1MAPTLMNA | |
| SCHEMBL9778011 | 0.80 | ALDH1A1 (0.44) | MAPK1ALDH1A1MAPTLMNAKMT2A | |
| SCHEMBL9773949 | 0.79 | ALDH1A1 (0.56) | MAPK1ALDH1A1MAPTKMT2A | |
| SCHEMBL14597968 | 0.77 | HDAC1 (0.67) | POLBMAPK1HSD17B10KMT2APTPN1 | |
| SCHEMBL29236542 | 0.77 | NPC1 (0.74) | POLBMAPK1SMN1; SMN2HTTALOX15 | |
| SCHEMBL29236529 | 0.77 | CASP3 (0.53) | POLBMAPK1SMN1; SMN2HTTHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| CN-118184477-A | Method for preparing chiral amino alcohol compound by catalyzing amino ketone with nickel metal by using water as hydrogen source | 云南民族大学 | 2024-06-14 | — | — | CN | disclosed |