Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 10/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 7/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.39 |
| ▸ | ABCC1 | P33527 | 3/20 | 0.37 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL25875596 | 0.87 | ADORA2A (0.50) | ABCG2ADORA3ADORA2AADORA1GABRA1 | |
| SCHEMBL27453612 | 0.87 | ABCG2 (0.49) | ABCG2ABCB1GABRA1GABRG2GABRB3 | |
| SCHEMBL27453359 | 0.87 | ABCG2 (0.49) | ABCG2ABCB1GABRA1GABRG2GABRB3 | |
| SCHEMBL27453377 | 0.85 | ABCG2 (0.50) | ABCG2ABCB1GABRA1GABRG2GABRB3 | |
| SCHEMBL27453368 | 0.84 | ABCG2 (0.49) | ABCG2ABCB1GABRA1GABRG2GABRB3 | |
| SCHEMBL27453706 | 0.84 | ABCG2 (0.49) | ABCG2ABCB1GABRA1GABRG2GABRB3 | |
| SCHEMBL25875152 | 0.84 | GABRG2 (0.40) | ADORA3ADORA2AADORA1GABRA1GABRG2 | |
| SCHEMBL27368445 | 0.83 | ABCG2 (0.46) | ABCG2ABCB1GABRA1GABRG2GABRB3 | |
| SCHEMBL31643072 | 0.83 | ABCG2 (0.48) | ABCG2ABCB1GABRA1GABRG2GABRB3 | |
| SCHEMBL31643499 | 0.83 | ABCG2 (0.48) | ABCG2ABCB1GABRA1GABRG2GABRB3 |
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-2023140649-A1 | NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | 주식회사 엘지화학 | 2023-07-27 | — | — | WO | disclosed |