Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 14/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 8/20 | 0.46 |
| ▸ | ABCC1 | P33527 | 3/20 | 0.41 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.40 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.40 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | MYC | P01106 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL25875320 | 0.99 | ABCG2 (0.47) | ABCG2ABCB1ABCC1ALDH1A3GABRA1 | |
| SCHEMBL20404862 | 0.93 | ABCG2 (0.51) | ABCG2ABCB1ABCC1ALDH1A3GABRA1 | |
| SCHEMBL31005176 | 0.91 | ABCG2 (0.53) | ABCG2ABCB1ABCC1ALDH1A3GABRA1 | |
| SCHEMBL15308223 | 0.91 | ABCG2 (0.53) | ABCG2ABCB1ABCC1ALDH1A3GABRA1 | |
| SCHEMBL21849411 | 0.91 | ABCG2 (0.53) | ABCG2ABCB1ABCC1ALDH1A3GABRA1 | |
| SCHEMBL29450769 | 0.89 | ABCG2 (0.54) | ABCG2ABCB1ABCC1ALDH1A3GABRA1 | |
| SCHEMBL21849416 | 0.89 | ABCG2 (0.54) | ABCG2ABCB1ABCC1ALDH1A3GABRA1 | |
| SCHEMBL18469028 | 0.88 | ADORA3 (0.45) | ABCG2MEN1KMT2A | |
| SCHEMBL29458359 | 0.88 | ADORA3 (0.45) | ABCG2MEN1KMT2A | |
| SCHEMBL29706115 | 0.87 | ABCG2 (0.47) | ABCG2ABCB1ABCC1MEN1KMT2A |
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 |