Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 1/20 | 0.32 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.31 |
| ▸ | AKR1C2 | P52895 | 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 | |
|---|---|---|---|---|
| SCHEMBL24744457 | 0.95 | PDK2 (0.33) | PDK2AKR1C3AKR1C2 | |
| SCHEMBL24744444 | 0.95 | AKR1C3 (0.33) | PDK2AKR1C3AKR1C2 | |
| SCHEMBL22183037 | 0.92 | PDK2 (0.33) | PDK2AKR1C3AKR1C2 | |
| SCHEMBL24744451 | 0.91 | PDK2 (0.32) | PDK2AKR1C3AKR1C2 | |
| SCHEMBL24744447 | 0.91 | CA12 (0.33) | PDK2AKR1C3AKR1C2 | |
| SCHEMBL24744449 | 0.90 | CA12 (0.33) | PDK2AKR1C3AKR1C2 | |
| SCHEMBL24744193 | 0.89 | PDK2 (0.33) | PDK2 | |
| SCHEMBL24744454 | 0.89 | CA12 (0.34) | AKR1C3AKR1C2 | |
| SCHEMBL24745007 | 0.88 | — | — | |
| SCHEMBL24744524 | 0.88 | CA12 (0.33) | — |
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-2022260240-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | 엘티소재주식회사 | 2022-12-15 | — | — | WO | disclosed |