Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MDM2 | Q00987 | 3/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.48 |
| ▸ | KLK7 | P49862 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 5/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.46 |
| ▸ | FNTA | P49354 | 1/20 | 0.46 |
| ▸ | FNTB | P49356 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28987197 | 1.00 | MDM2 (0.58) | MDM2ALDH1A1MAPTKDM4ENPC1 | |
| SCHEMBL28987198 | 0.92 | MDM2 (0.56) | MDM2ALDH1A1MAPTKDM4ENPC1 | |
| SCHEMBL22215228 | 0.91 | ALDH1A1 (0.64) | MDM2ALDH1A1MAPTKDM4ENPC1 | |
| SCHEMBL28987193 | 0.91 | ALDH1A1 (0.64) | MDM2ALDH1A1MAPTKDM4ENPC1 | |
| SCHEMBL28987196 | 0.90 | MDM2 (0.54) | MDM2ALDH1A1MAPTKDM4ENPC1 | |
| SCHEMBL28987192 | 0.90 | MDM2 (0.54) | MDM2ALDH1A1MAPTKDM4ENPC1 | |
| SCHEMBL28987200 | 0.89 | MDM2 (0.55) | MDM2ALDH1A1MAPTKDM4ENPC1 | |
| SCHEMBL28987204 | 0.89 | MDM2 (0.55) | MDM2ALDH1A1MAPTKDM4ENPC1 | |
| SCHEMBL30341617 | 0.89 | MDM2 (0.55) | MDM2ALDH1A1MAPTKDM4ENPC1 | |
| SCHEMBL28987227 | 0.88 | ALDH1A1 (0.56) | MDM2ALDH1A1MAPTKDM4ENPC1 |
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-116003272-A | Asymmetric catalytic synthesis method of AK-3 chiral alpha-amino ketone | 常州大学 | 2023-04-25 | — | — | CN | disclosed |