Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 2/20 | 0.40 |
| ▸ | FABP4 | P15090 | 6/20 | 0.36 |
| ▸ | FABP5 | Q01469 | 4/20 | 0.36 |
| ▸ | FABP3 | P05413 | 1/20 | 0.36 |
| ▸ | MYC | P01106 | 1/20 | 0.34 |
| ▸ | MAX | P61244 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CDC25B | P30305 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.33 |
| ▸ | MAPK13 | O15264 | 2/20 | 0.33 |
| ▸ | MAPK12 | P53778 | 2/20 | 0.33 |
| ▸ | MAPK11 | Q15759 | 2/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.32 |
| ▸ | AURKA | O14965 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20794292 | 1.00 | PDK2 (0.40) | PDK2FABP4FABP5FABP3MYC | |
| SCHEMBL25672806 | 0.94 | PDK2 (0.42) | PDK2FABP4FABP5FABP3MYC | |
| SCHEMBL10136256 | 0.86 | PDK2 (0.48) | PDK2ALDH1A1HDAC1MAPK14SMN1; SMN2 | |
| SCHEMBL22662299 | 0.86 | PDK2 (0.34) | PDK2HDAC1SMN1; SMN2LMNA | |
| SCHEMBL10136255 | 0.85 | PDK2 (0.47) | PDK2ALDH1A1HDAC1MAPK14SMN1; SMN2 | |
| SCHEMBL30691815 | 0.84 | PDK2 (0.55) | PDK2ALDH1A1MAPK14SMN1; SMN2LMNA | |
| SCHEMBL14565869 | 0.84 | PDK2 (0.55) | PDK2ALDH1A1MAPK14SMN1; SMN2LMNA | |
| SCHEMBL10136261 | 0.84 | PDK2 (0.47) | PDK2ALDH1A1MAPK14SMN1; SMN2LMNA | |
| SCHEMBL14340269 | 0.83 | PDK2 (0.54) | PDK2ALDH1A1MAPK14SMN1; SMN2LMNA | |
| SCHEMBL12424029 | 0.83 | PDK2 (0.45) | PDK2ALDH1A1HDAC1SMN1; SMN2LMNA |
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-111094234-B | Organic compound and organic electroluminescent element comprising same | 材料科学有限公司 | 2023-08-22 | — | — | CN | disclosed |