Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 3/20 | 0.35 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.34 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.33 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19873768 | 1.00 | PDK2 (0.35) | PDK2ENPP2NFE2L2GPBAR1ACHE | |
| SCHEMBL5308 | 0.82 | ENPP2 (0.35) | ENPP2 | |
| SCHEMBL28676771 | 0.82 | ENPP2 (0.40) | ENPP2NFE2L2ACHE | |
| SCHEMBL29469152 | 0.82 | ENPP2 (0.35) | ENPP2 | |
| SCHEMBL25344613 | 0.79 | ERN1 (0.41) | PDK2ENPP2ACHE | |
| SCHEMBL29829580 | 0.79 | ERN1 (0.41) | PDK2ENPP2ACHE | |
| SCHEMBL31067139 | 0.78 | PDK2 (0.38) | PDK2NFE2L2ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL20898317 | 0.78 | PDK2 (0.38) | PDK2NFE2L2ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL910658 | 0.77 | ENPP2 (0.50) | ENPP2 | |
| SCHEMBL22703498 | 0.74 | CYP2A6 (0.44) | ENPP2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3708566-B1 | NOVEL HETEROCYCLIC COMPOUNDS AND THE USE THEREOF IN MEDICINE AND IN COSMETICS | GALDERMA RES & DEV (FR) | 2023-02-08 | — | — | EP | disclosed |