Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KA2 | Q15349 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | F2 | P00734 | 1/20 | 0.43 |
| ▸ | VDR | P11473 | 1/20 | 0.43 |
| ▸ | MMP2 | P08253 | 1/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29236539 | 1.00 | RPS6KA2 (0.52) | RPS6KA2ALDH1A1MAPK1KMT2AMEN1 | |
| SCHEMBL29236536 | 0.86 | ALDH1A1 (0.51) | RPS6KA2ALDH1A1MAPK1KMT2AMEN1 | |
| SCHEMBL29236534 | 0.86 | ALDH1A1 (0.51) | RPS6KA2ALDH1A1MAPK1KMT2AMEN1 | |
| SCHEMBL9773949 | 0.84 | ALDH1A1 (0.56) | ALDH1A1MAPK1KMT2AMAPTRAB9A | |
| SCHEMBL9777977 | 0.82 | ALDH1A1 (0.49) | ALDH1A1MAPK1KMT2AMEN1LMNA | |
| SCHEMBL29236529 | 0.81 | CASP3 (0.53) | RPS6KA2ALDH1A1MAPK1KMT2AMAPT | |
| SCHEMBL29236527 | 0.81 | CASP3 (0.53) | RPS6KA2ALDH1A1MAPK1KMT2AMAPT | |
| SCHEMBL9777967 | 0.81 | ALDH1A1 (0.47) | ALDH1A1MAPK1KMT2AMEN1MAPT | |
| SCHEMBL29236566 | 0.81 | ALDH1A1 (0.47) | ALDH1A1MAPK1KMT2AMAPTRAB9A | |
| SCHEMBL29236568 | 0.81 | ALDH1A1 (0.47) | ALDH1A1MAPK1KMT2AMEN1MAPT |
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 |