Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.37 |
| ▸ | CHRNG | P07510 | 1/20 | 0.37 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | CHRND | Q07001 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 2/20 | 0.35 |
| ▸ | STK10 | O94804 | 1/20 | 0.35 |
| ▸ | SLK | Q9H2G2 | 1/20 | 0.35 |
| ▸ | NTSR1 | P30989 | 2/20 | 0.34 |
| ▸ | FADS1 | O60427 | 1/20 | 0.34 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23137765 | 1.00 | PDK2 (0.41) | PDK2ALDH1A1MAPTCHRNA1CHRNG | |
| SCHEMBL27012236 | 0.94 | PDK2 (0.39) | PDK2ALDH1A1MAPTCHRNA1CHRNG | |
| SCHEMBL25125199 | 0.92 | MAPT (0.39) | PDK2ALDH1A1MAPTCHRNA1CHRNG | |
| SCHEMBL29407519 | 0.91 | PDK2 (0.42) | PDK2ALDH1A1MAPTCHRNB4CHRNA3 | |
| SCHEMBL13367457 | 0.91 | PDK2 (0.42) | PDK2ALDH1A1MAPTCHRNB4CHRNA3 | |
| SCHEMBL10034426 | 0.91 | MCL1 (0.39) | PDK2ALDH1A1MAPTCHRNA1CHRNG | |
| SCHEMBL23137620 | 0.90 | PDK2 (0.40) | PDK2ALDH1A1MAPTBRD4FADS1 | |
| SCHEMBL21386482 | 0.90 | PDK2 (0.44) | PDK2ALDH1A1MAPTSTK10SLK | |
| SCHEMBL31245664 | 0.89 | ALDH1A1 (0.39) | PDK2ALDH1A1MAPTNTSR1MCL1 | |
| SCHEMBL25569223 | 0.87 | ALDH1A1 (0.38) | PDK2ALDH1A1MAPTCHRNA1CHRNG |
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 |
|---|---|---|---|---|---|---|---|
| CN-118488943-A | Compound and organic light emitting device comprising the same | 株式会社LG化学 | 2024-08-13 | — | — | CN | disclosed |