Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 12/20 | 0.66 |
| ▸ | BTK | Q06187 | 6/20 | 0.66 |
| ▸ | ITK | Q08881 | 4/20 | 0.66 |
| ▸ | JAK3 | P52333 | 2/20 | 0.66 |
| ▸ | JAK2 | O60674 | 1/20 | 0.66 |
| ▸ | LYN | P07948 | 1/20 | 0.66 |
| ▸ | TEC | P42680 | 1/20 | 0.66 |
| ▸ | TXK | P42681 | 1/20 | 0.66 |
| ▸ | BMX | P51813 | 1/20 | 0.66 |
| ▸ | CD69 | Q07108 | 1/20 | 0.66 |
| ▸ | SYK | P43405 | 4/20 | 0.60 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.56 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.56 |
| ▸ | CDK2 | P24941 | 1/20 | 0.56 |
| ▸ | CDK9 | P50750 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL28908376 | 0.89 | EGFR (0.62) | EGFRBTKITKJAK3JAK2 | |
| SCHEMBL30843981 | 0.88 | EGFR (0.72) | EGFRBTKITKJAK3JAK2 | |
| SCHEMBL28711237 | 0.88 | EGFR (0.72) | EGFRBTKITKJAK3JAK2 | |
| SCHEMBL28720308 | 0.88 | EGFR (0.65) | EGFRBTKITKJAK3JAK2 | |
| Benzohydroxamate SCHEMBL29172335 | 0.85 | EGFR (0.62) | EGFRBTKITKJAK3JAK2 | |
| SCHEMBL30726866 | 0.84 | EGFR (0.68) | EGFRBTKITKJAK3JAK2 | |
| SCHEMBL28908383 | 0.84 | EGFR (0.68) | EGFRBTKITKJAK3JAK2 | |
| SCHEMBL30726867 | 0.83 | EGFR (0.67) | EGFRBTKITKJAK3JAK2 | |
| SCHEMBL28908362 | 0.83 | EGFR (0.67) | EGFRBTKITKJAK3JAK2 | |
| SCHEMBL12518393 | 0.82 | EGFR (0.73) | EGFRBTKITKJAK3JAK2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115286583-A | Diphenylaminopyrimidine-containing compound, preparation and application thereof as HDACs enzyme inhibitor | 山东大学 | 2022-11-04 | — | — | CN | claimed |
| CN-115286583-B | Diphenylamino pyrimidine-containing compound, preparation and application thereof as HDACs enzyme inhibitor | 山东大学 | 2024-01-30 | — | — | CN | disclosed |
| CN-115286583-A | Diphenylaminopyrimidine-containing compound, preparation and application thereof as HDACs enzyme inhibitor | 山东大学 | 2022-11-04 | — | — | CN | disclosed |