Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 5/20 | 0.50 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | CLK4 | Q9HAZ1 | 5/20 | 0.45 |
| ▸ | LMNA | P02545 | 5/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | USP2 | O75604 | 2/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL25875141 | 0.87 | ABCG2 (0.41) | ADORA2AADORA1ADORA3ALDH1A1ABCG2 | |
| SCHEMBL25875152 | 0.87 | GABRG2 (0.40) | ADORA2AADORA1ADORA3ALDH1A1MEN1 | |
| SCHEMBL27453375 | 0.86 | CYP1A2 (0.53) | ADORA2AADORA1ADORA3CYP1A2CYP3A4 | |
| SCHEMBL27453370 | 0.86 | CYP1A2 (0.53) | ADORA2AADORA1ADORA3CYP1A2CYP3A4 | |
| SCHEMBL27453707 | 0.86 | CYP1A2 (0.53) | ADORA2AADORA1ADORA3CYP1A2CYP3A4 | |
| SCHEMBL27453711 | 0.85 | CYP1A2 (0.52) | ADORA2AADORA1ADORA3CYP1A2CYP3A4 | |
| SCHEMBL27453488 | 0.85 | CYP1A2 (0.54) | ADORA2AADORA1ADORA3CYP1A2CYP3A4 | |
| SCHEMBL27453380 | 0.85 | CYP1A2 (0.54) | ADORA2AADORA1ADORA3CYP1A2CYP3A4 | |
| SCHEMBL27453713 | 0.84 | CYP1A2 (0.51) | ADORA2AADORA1ADORA3CYP1A2CYP3A4 | |
| SCHEMBL27453614 | 0.82 | CYP1A2 (0.52) | ADORA2AADORA1ADORA3CYP1A2CYP3A4 |
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 |