Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 2/20 | 0.33 |
| ▸ | MAOB | P27338 | 2/20 | 0.33 |
| ▸ | CHKA | P35790 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13250591 | 0.88 | ALDH1A1 (0.39) | ALDH1A1HDAC6CYP2D6CYP2C19MAOA | |
| SCHEMBL13321045 | 0.84 | ALDH1A1 (0.35) | ALDH1A1HDAC6CYP2D6CYP2C19MAOA | |
| SCHEMBL13321039 | 0.83 | ALDH1A1 (0.36) | ALDH1A1HDAC6CYP2D6CYP2C19MAOA | |
| SCHEMBL27366599 | 0.83 | LMNA (0.35) | ALDH1A1CYP2D6CYP2C19MAOAMAOB | |
| SCHEMBL13320962 | 0.81 | ALDH1A1 (0.33) | ALDH1A1HDAC6CYP2D6CYP2C19MAOA | |
| SCHEMBL17342431 | 0.81 | ALDH1A1 (0.35) | ALDH1A1HDAC6CYP2D6CYP2C19MAOA | |
| SCHEMBL15250287 | 0.80 | — | — | |
| SCHEMBL31142139 | 0.80 | ALDH1A1 (0.39) | ALDH1A1CYP2D6CYP2C19TSHRKDM4E | |
| SCHEMBL134697 | 0.80 | ALDH1A1 (0.39) | ALDH1A1CYP2D6CYP2C19TSHRKDM4E | |
| SCHEMBL4647647 | 0.80 | ALDH1A1 (0.45) | ALDH1A1HDAC6CYP2D6CYP2C19MAOA |
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-2024035190-A1 | ORGANIC LIGHT-EMITTING DIODE AND ORGANIC COMPOUND | 솔루스첨단소재 주식회사 | 2024-02-15 | — | — | WO | disclosed |