Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 3/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL23439358 | 0.92 | RXRA (0.38) | PGR | |
| SCHEMBL24561695 | 0.88 | PDK2 (0.35) | PDK2PGRSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL23439049 | 0.84 | RXRA (0.41) | PGR | |
| SCHEMBL23439470 | 0.83 | PDK2 (0.31) | PDK2 | |
| SCHEMBL17780704 | 0.80 | PDK2 (0.36) | PDK2PGRSLC6A2SLC6A4CYP1A2 | |
| SCHEMBL24647255 | 0.80 | PDK2 (0.34) | PDK2 | |
| SCHEMBL23439317 | 0.80 | — | — | |
| SCHEMBL24904657 | 0.79 | PDK2 (0.34) | PDK2 | |
| SCHEMBL14274562 | 0.79 | ALDH1A1 (0.39) | PDK2CYP1A2 | |
| SCHEMBL24561535 | 0.78 | CYP1A2 (0.46) | SLC6A2SLC6A4SLC6A3CYP1A2 |
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-2021107711-A1 | POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME | 주식회사 엘지화학 | 2021-06-03 | — | — | WO | disclosed |