Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 13/20 | 0.58 |
| ▸ | BTK | Q06187 | 8/20 | 0.58 |
| ▸ | ITK | Q08881 | 5/20 | 0.58 |
| ▸ | JAK2 | O60674 | 1/20 | 0.58 |
| ▸ | LYN | P07948 | 1/20 | 0.58 |
| ▸ | TEC | P42680 | 1/20 | 0.58 |
| ▸ | TXK | P42681 | 1/20 | 0.58 |
| ▸ | BMX | P51813 | 1/20 | 0.58 |
| ▸ | JAK3 | P52333 | 1/20 | 0.58 |
| ▸ | CD69 | Q07108 | 1/20 | 0.58 |
| ▸ | MAP2K7 | O14733 | 1/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.52 |
| ▸ | TGM2 | P21980 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL14707651 | 0.85 | EGFR (0.59) | EGFRBTKITKMAP2K7THRB | |
| SCHEMBL5037362 | 0.85 | MAP2K7 (0.59) | EGFRITKMAP2K7THRBTGM2 | |
| SCHEMBL28310060 | 0.83 | TGM2 (0.67) | EGFRBTKITKJAK2LYN | |
| SCHEMBL1383792 | 0.83 | TGM2 (0.66) | EGFRITKTGM2 | |
| SCHEMBL31069810 | 0.83 | TGM2 (0.66) | EGFRITKTGM2 | |
| SCHEMBL12518303 | 0.82 | EGFR (0.88) | EGFRBTKITKJAK2LYN | |
| SCHEMBL30935137 | 0.80 | TGM2 (0.47) | EGFRBTKITKJAK2LYN | |
| SCHEMBL28463718 | 0.80 | EGFR (0.63) | EGFRBTKITKJAK2LYN | |
| SCHEMBL30935289 | 0.78 | BTK (0.43) | EGFRBTKITKJAK2LYN | |
| SCHEMBL184081 | 0.78 | TP53 (0.56) | EGFRBTKITKMAP2K7TGM2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110041331-B | Styrylxanthine derivative and use thereof | 广东东阳光药业有限公司 | 2020-08-07 | — | — | CN | disclosed |
| CN-110041331-A | Styryl xanthine derivative and application thereof | 广东东阳光药业有限公司 | 2019-07-23 | — | — | CN | disclosed |