Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | ACP1 | P24666 | 1/20 | 0.40 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.38 |
| ▸ | NAT1 | P18440 | 1/20 | 0.38 |
| ▸ | P2RY4 | P51582 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.36 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30675131 | 0.94 | ALDH1A1 (0.50) | ALDH1A1MAPK1ACP1ABCG2SLC6A3 | |
| SCHEMBL26877419 | 0.94 | ALDH1A1 (0.50) | ALDH1A1MAPK1ACP1ABCG2SLC6A3 | |
| SCHEMBL22435841 | 0.92 | PTGER4 (0.42) | ALDH1A1MAPK1AKR1C3PTGER4NPC1 | |
| SCHEMBL30597412 | 0.89 | ALDH1A1 (0.47) | ALDH1A1MAPK1ACP1ABCG2AKR1C3 | |
| SCHEMBL22137197 | 0.89 | ALDH1A1 (0.47) | ALDH1A1MAPK1ACP1ABCG2AKR1C3 | |
| SCHEMBL22435700 | 0.85 | ALK (0.42) | ALDH1A1MAPK1AKR1C3PTGER4NPC1 | |
| SCHEMBL22435840 | 0.85 | ALK (0.42) | ALDH1A1MAPK1AKR1C3PTGER4NPC1 | |
| SCHEMBL22435802 | 0.85 | ALK (0.46) | ALDH1A1MAPK1AKR1C3PTGER4NPC1 | |
| SCHEMBL20484337 | 0.85 | ALK (0.46) | ALDH1A1MAPK1AKR1C3PTGER4NPC1 | |
| SCHEMBL15662804 | 0.85 | ALK (0.46) | ALDH1A1MAPK1AKR1C3PTGER4NPC1 |
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-113994495-A | Organic light emitting device | 株式会社LG化学 | 2022-01-28 | — | — | CN | disclosed |