Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | ANPEP | P15144 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28270641 | 0.90 | ALDH1A1 (0.58) | ALDH1A1KMT2AMEN1NPC1RAB9A | |
| SCHEMBL1309285 | 0.88 | ALDH1A1 (0.52) | ALDH1A1KMT2AMEN1NPC1SMN1; SMN2 | |
| SCHEMBL28272233 | 0.87 | TP53 (0.49) | ALDH1A1KMT2AMEN1NPC1RAB9A | |
| SCHEMBL28272245 | 0.82 | ALDH1A1 (0.56) | ALDH1A1KMT2AMEN1SMN1; SMN2TDP1 | |
| SCHEMBL14595548 | 0.80 | NPC1 (0.63) | ALDH1A1KMT2AMEN1NPC1RAB9A | |
| SCHEMBL4978745 | 0.75 | SLC6A9 (0.56) | ALDH1A1KMT2AMEN1NPC1RAB9A | |
| SCHEMBL1308387 | 0.73 | LMNA (0.54) | ALDH1A1KMT2AMEN1NPC1RAB9A | |
| SCHEMBL14595547 | 0.73 | LMNA (0.56) | ALDH1A1KMT2ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28272227 | 0.73 | ANPEP (0.43) | ALDH1A1KMT2AMEN1NPC1RAB9A | |
| SCHEMBL7047478 | 0.72 | SLC6A9 (0.56) | ALDH1A1KMT2AMEN1NPC1HTT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109096138-B | Method for synthesizing alpha-aminoketone derivative | 郑州轻工业学院 | 2020-12-18 | — | — | CN | disclosed |
| CN-109096138-A | A method of synthesis α-amido ketone derivatives | 郑州轻工业学院 | 2018-12-28 | — | — | CN | disclosed |