Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 5/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.34 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.34 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.32 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.32 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.31 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.31 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.31 |
| ▸ | STK10 | O94804 | 1/20 | 0.30 |
| ▸ | SLK | Q9H2G2 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25799519 | 0.94 | PDK2 (0.39) | PDK2MAPK14CYP1A2TSHRPGR | |
| SCHEMBL22987273 | 0.89 | PDK2 (0.39) | PDK2MAPK14MAPK8MAPK10CYP1A2 | |
| SCHEMBL26028649 | 0.88 | PDK2 (0.41) | PDK2MAPK14MAPK8MAPK10SIRT2 | |
| SCHEMBL23288332 | 0.88 | PDK2 (0.41) | PDK2MAPK14MAPK8MAPK10SIRT2 | |
| SCHEMBL31143726 | 0.88 | PDK2 (0.41) | PDK2MAPK14MAPK8MAPK10SIRT2 | |
| SCHEMBL29440305 | 0.88 | PDK2 (0.43) | PDK2MAPK14MAPK13MAPK12MAPK11 | |
| SCHEMBL796162 | 0.88 | PDK2 (0.43) | PDK2MAPK14MAPK13MAPK12MAPK11 | |
| SCHEMBL25125241 | 0.86 | PDK2 (0.36) | PDK2MAPK14PGRSIRT2SIRT1 | |
| SCHEMBL21913818 | 0.86 | KDM4E (0.42) | PDK2TSHRTP53MAPT | |
| SCHEMBL19163603 | 0.85 | PDK2 (0.41) | PDK2MAPK14SIRT2SIRT1MAPK13 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023273998-A1 | COMPOUND AND APPLICATION THEREOF, AND ORGANIC ELECTROLUMINESCENT DEVICE | 北京鼎材科技有限公司 | 2023-01-05 | — | — | WO | disclosed |
| WO-2023273997-A1 | ORGANIC COMPOUND AND APPLICATION THEREOF | 北京鼎材科技有限公司 | 2023-01-05 | — | — | WO | disclosed |