Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28973318 | 0.89 | ADORA2B (0.30) | ADORA2B | |
| SCHEMBL28973309 | 0.88 | CYP1A2 (0.31) | — | |
| Iodide SCHEMBL28973307 | 0.87 | TSHR (0.31) | — | |
| SCHEMBL28973362 | 0.84 | NPSR1 (0.35) | ADORA2B | |
| SCHEMBL28973363 | 0.84 | — | — | |
| SCHEMBL28973359 | 0.80 | CYP1A2 (0.31) | — | |
| SCHEMBL28973360 | 0.76 | NPSR1 (0.35) | ADORA2B | |
| Iodide SCHEMBL28973311 | 0.74 | TSHR (0.31) | — | |
| Iodide SCHEMBL28973364 | 0.74 | CYP1A2 (0.35) | — | |
| SCHEMBL15075735 | 0.70 | L3MBTL1 (0.37) | — |
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-115850279-A | Theophylline derived autoignition ionic salt and preparation method thereof | 哈尔滨工业大学（深圳） | 2023-03-28 | — | — | CN | disclosed |