Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | PARP1 | P09874 | 1/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.48 |
| ▸ | AHR | P35869 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL21448261 | 1.00 | ALDH1A1 (0.50) | ALDH1A1HPGDLMNAPARP1CYP2A6 | |
| SCHEMBL21451721 | 0.89 | PARP1 (0.50) | ALDH1A1HPGDLMNAPARP1CYP2A6 | |
| SCHEMBL21448352 | 0.89 | MEN1 (0.51) | ALDH1A1HPGDLMNACYP2A6AHR | |
| SCHEMBL30180727 | 0.89 | MEN1 (0.51) | ALDH1A1HPGDLMNACYP2A6AHR | |
| SCHEMBL21966529 | 0.86 | CYP2A6 (0.52) | ALDH1A1HPGDLMNAPARP1CYP2A6 | |
| SCHEMBL30180806 | 0.84 | AHR (0.57) | ALDH1A1HPGDLMNACYP2A6AHR | |
| SCHEMBL30180942 | 0.84 | AHR (0.57) | ALDH1A1HPGDLMNACYP2A6AHR | |
| SCHEMBL21448183 | 0.84 | AHR (0.57) | ALDH1A1HPGDLMNACYP2A6AHR | |
| SCHEMBL21448386 | 0.84 | AHR (0.57) | ALDH1A1HPGDLMNACYP2A6AHR | |
| SCHEMBL2141394 | 0.83 | PARP1 (0.61) | ALDH1A1HPGDLMNAPARP1AHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-110024155-B | Organic light emitting device | 株式会社LG化学 | 2023-07-04 | — | — | CN | disclosed |
| CN-110291066-B | Compound and organic electroluminescent element comprising same | 株式会社LG化学（KR） | 2023-01-13 | — | — | CN | disclosed |