Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 6/20 | 0.63 |
| ▸ | PDK2 | Q15119 | 6/20 | 0.63 |
| ▸ | PDK3 | Q15120 | 6/20 | 0.63 |
| ▸ | PDK4 | Q16654 | 6/20 | 0.63 |
| ▸ | MEN1 | O00255 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.59 |
| ▸ | RAB9A | P51151 | 6/20 | 0.56 |
| ▸ | NPC1 | O15118 | 5/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL28014751 | 0.88 | PDK1 (0.62) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL22185077 | 0.80 | HDAC3 (0.62) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL28014053 | 0.77 | NPC1 (0.54) | MEN1KMT2ARAB9ANPC1ALDH1A1 | |
| SCHEMBL5546903 | 0.77 | PDK1 (0.71) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL28014766 | 0.77 | MEN1 (0.54) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL31490980 | 0.76 | PDK1 (0.69) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL23838114 | 0.74 | MAPK1 (0.47) | PDK1PDK2PDK3PDK4RAB9A | |
| SCHEMBL31572512 | 0.73 | RAB9A (0.57) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL14786380 | 0.72 | MEN1 (0.52) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL11356431 | 0.72 | L3MBTL1 (0.73) | PDK1PDK2PDK3PDK4MEN1 |
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-103288669-B | Atrolactic acid amide derivative and applications thereof | UNIV NANKAI | 2015-06-24 | — | — | CN | disclosed |