Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | KCNK18 | Q7Z418 | 1/20 | 0.36 |
| ▸ | PON1 | P27169 | 1/20 | 0.36 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 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 | |
|---|---|---|---|---|
| SCHEMBL29640000 | 0.96 | ALDH1A1 (0.38) | ALDH1A1MAPTABCG2MEN1CYP1A2 | |
| SCHEMBL23439342 | 0.96 | ALDH1A1 (0.38) | ALDH1A1MAPTABCG2MEN1CYP1A2 | |
| SCHEMBL23421832 | 0.95 | ALDH1A1 (0.38) | ALDH1A1MAPTABCG2MEN1CYP1A2 | |
| SCHEMBL31069466 | 0.94 | ALDH1A1 (0.38) | ALDH1A1MAPTABCG2MEN1CYP1A2 | |
| SCHEMBL26599597 | 0.93 | ALDH1A1 (0.36) | ALDH1A1MAPTABCG2MEN1CYP1A2 | |
| SCHEMBL30363377 | 0.93 | ALDH1A1 (0.36) | ALDH1A1MAPTABCG2MEN1CYP1A2 | |
| SCHEMBL30271878 | 0.91 | ALDH1A1 (0.35) | ALDH1A1MAPTABCG2MEN1CYP1A2 | |
| SCHEMBL25219745 | 0.91 | ALDH1A1 (0.35) | ALDH1A1MAPTABCG2MEN1CYP1A2 | |
| SCHEMBL23439032 | 0.89 | SMN1; SMN2 (0.41) | ALDH1A1MAPTABCG2MEN1CYP1A2 | |
| SCHEMBL31069400 | 0.89 | SMN1; SMN2 (0.41) | ALDH1A1MAPTABCG2MEN1CYP1A2 |
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-113924307-B | Polycyclic compound and organic light-emitting element including the same | 株式会社LG化学 | 2024-08-20 | — | — | CN | disclosed |