Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 11/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 8/20 | 0.41 |
| ▸ | ABCC1 | P33527 | 3/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.36 |
| ▸ | KDM4A | O75164 | 1/20 | 0.36 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | MYC | P01106 | 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 | |
|---|---|---|---|---|
| SCHEMBL25038460 | 0.89 | ABCG2 (0.39) | ABCG2ABCB1ABCC1GABRA1GABRG2 | |
| SCHEMBL25038575 | 0.87 | ABCG2 (0.39) | ABCG2ABCB1ABCC1GABRA1GABRG2 | |
| SCHEMBL25036065 | 0.86 | ABCG2 (0.39) | ABCG2ABCB1ABCC1GABRA1GABRG2 | |
| SCHEMBL25038647 | 0.86 | ABCG2 (0.39) | ABCG2ABCB1ABCC1GABRA1GABRG2 | |
| SCHEMBL25036038 | 0.85 | ABCG2 (0.38) | ABCG2ABCB1ABCC1GABRA1GABRG2 | |
| SCHEMBL25036003 | 0.84 | HSD17B10 (0.39) | ABCG2ADORA2AADORA1MAPK1L3MBTL1 | |
| SCHEMBL19942328 | 0.81 | ABCG2 (0.48) | ABCG2ABCB1ABCC1GABRA1GABRG2 | |
| SCHEMBL25036009 | 0.80 | L3MBTL1 (0.39) | ADORA2AADORA1MAPK1L3MBTL1HSD17B10 | |
| SCHEMBL19942327 | 0.80 | ABCG2 (0.49) | ABCG2ABCB1ABCC1GABRA1GABRG2 | |
| SCHEMBL19202851 | 0.80 | ALDH1A1 (0.45) | ADORA2AADORA1MAPK1L3MBTL1HSD17B10 |
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-2023018267-A1 | NOVEL COMPOUND, AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2023-02-16 | — | — | WO | disclosed |