Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 14/20 | 0.68 |
| ▸ | LCK | P06239 | 4/20 | 0.68 |
| ▸ | ITK | Q08881 | 3/20 | 0.68 |
| ▸ | EGFR | P00533 | 2/20 | 0.68 |
| ▸ | JAK3 | P52333 | 2/20 | 0.68 |
| ▸ | NUDT14 | O95848 | 1/20 | 0.61 |
| ▸ | NUDT5 | Q9UKK9 | 1/20 | 0.61 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.59 |
| ▸ | MTOR | P42345 | 3/20 | 0.59 |
| ▸ | FYN | P06241 | 3/20 | 0.56 |
| ▸ | LYN | P07948 | 3/20 | 0.56 |
| ▸ | HCK | P08631 | 3/20 | 0.56 |
| ▸ | FGR | P09769 | 3/20 | 0.56 |
| ▸ | SRC | P12931 | 3/20 | 0.56 |
| ▸ | FLT3 | P36888 | 3/20 | 0.56 |
| ▸ | MAP2K1 | Q02750 | 3/20 | 0.56 |
| ▸ | PTK6 | Q13882 | 3/20 | 0.56 |
| ▸ | BRAF | P15056 | 3/20 | 0.56 |
| ▸ | YES1 | P07947 | 2/20 | 0.56 |
| ▸ | BLK | P51451 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28477160 | 0.94 | BTK (0.66) | BTKLCKITKEGFRJAK3 | |
| SCHEMBL28476170 | 0.93 | HDAC1 (0.69) | BTKLCKITKEGFRJAK3 | |
| SCHEMBL28469313 | 0.93 | HDAC1 (0.71) | BTKLCKITKEGFRJAK3 | |
| SCHEMBL28468967 | 0.90 | BTK (0.65) | BTKLCKITKEGFRJAK3 | |
| SCHEMBL30172740 | 0.89 | BTK (0.64) | BTKLCKITKEGFRJAK3 | |
| SCHEMBL28927604 | 0.89 | BTK (0.64) | BTKLCKITKEGFRJAK3 | |
| SCHEMBL15517319 | 0.85 | BTK (0.81) | BTKLCKITKEGFRJAK3 | |
| SCHEMBL28416640 | 0.85 | BTK (0.74) | BTKLCKITKEGFRJAK3 | |
| SCHEMBL17090646 | 0.84 | BTK (0.80) | BTKLCKITKEGFRJAK3 | |
| SCHEMBL14617791 | 0.83 | BTK (0.78) | BTKLCKITKEGFRJAK3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111662296-B | Hydroxamic acid derivative containing pyrazolopyrimidine and preparation method and application thereof | 山东大学 | 2021-12-31 | — | — | CN | claimed |
| CN-111662296-A | Hydroxamic acid derivative containing pyrazolopyrimidine and preparation method and application thereof | 山东大学 | 2020-09-15 | — | — | CN | claimed |
| CN-111662296-B | Hydroxamic acid derivative containing pyrazolopyrimidine and preparation method and application thereof | 山东大学 | 2021-12-31 | — | — | CN | disclosed |
| CN-111662296-A | Hydroxamic acid derivative containing pyrazolopyrimidine and preparation method and application thereof | 山东大学 | 2020-09-15 | — | — | CN | disclosed |