Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 8/20 | 0.33 |
| ▸ | CTSD | P07339 | 2/20 | 0.31 |
| ▸ | BACE1 | P56817 | 2/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 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 | |
|---|---|---|---|---|
| SCHEMBL25852123 | 0.96 | KDM4E (0.34) | PDK2CTSDBACE1ESR1ESR2 | |
| SCHEMBL25851472 | 0.93 | PDK2 (0.32) | PDK2CTSDBACE1 | |
| SCHEMBL25853031 | 0.92 | KDM4E (0.35) | — | |
| SCHEMBL25852207 | 0.91 | PDK2 (0.33) | PDK2CTSDBACE1 | |
| SCHEMBL25852487 | 0.90 | PDK2 (0.33) | PDK2CTSDBACE1 | |
| SCHEMBL25864934 | 0.89 | PDK2 (0.32) | PDK2CTSDBACE1ESR1ESR2 | |
| SCHEMBL25853204 | 0.89 | KDM4E (0.37) | ESR1ESR2 | |
| SCHEMBL25864355 | 0.88 | ESR1 (0.36) | BACE1ESR1ESR2 | |
| SCHEMBL25864357 | 0.87 | MEN1 (0.40) | ESR1ESR2 | |
| SCHEMBL25850938 | 0.87 | PDK2 (0.36) | PDK2BACE1ESR1ESR2 |
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 |