Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 3/20 | 0.35 |
| ▸ | CTSD | P07339 | 1/20 | 0.31 |
| ▸ | BACE1 | P56817 | 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 | |
|---|---|---|---|---|
| SCHEMBL25874614 | 0.90 | PDK2 (0.36) | PDK2CTSDBACE1 | |
| SCHEMBL25875592 | 0.89 | MAPK1 (0.35) | PDK2BACE1 | |
| SCHEMBL25843054 | 0.88 | KDM4E (0.41) | PDK2 | |
| SCHEMBL19600422 | 0.87 | KDM4E (0.37) | PDK2 | |
| SCHEMBL25875723 | 0.86 | PDK2 (0.37) | PDK2BACE1 | |
| SCHEMBL25875589 | 0.86 | PDK2 (0.37) | PDK2BACE1 | |
| SCHEMBL25875201 | 0.86 | ESR1 (0.36) | PDK2 | |
| SCHEMBL25876587 | 0.85 | KDM4E (0.33) | — | |
| SCHEMBL25875483 | 0.85 | PDK2 (0.35) | PDK2 | |
| SCHEMBL25874936 | 0.85 | KDM4E (0.35) | PDK2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023120714-A1 | COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE | 出光興産株式会社 | 2023-06-29 | — | — | WO | disclosed |