Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 11/20 | 0.71 |
| ▸ | MTOR | P42345 | 6/20 | 0.71 |
| ▸ | BTK | Q06187 | 7/20 | 0.64 |
| ▸ | EGFR | P00533 | 2/20 | 0.64 |
| ▸ | LCK | P06239 | 2/20 | 0.64 |
| ▸ | JAK3 | P52333 | 2/20 | 0.64 |
| ▸ | ITK | Q08881 | 2/20 | 0.64 |
| ▸ | PDGFRB | P09619 | 3/20 | 0.64 |
| ▸ | KDR | P35968 | 3/20 | 0.64 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.64 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.64 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.64 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.64 |
| ▸ | NUDT14 | O95848 | 1/20 | 0.57 |
| ▸ | NUDT5 | Q9UKK9 | 1/20 | 0.57 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.55 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL28476170 | 0.99 | HDAC1 (0.69) | HDAC1MTORBTKEGFRLCK | |
| SCHEMBL28477160 | 0.96 | BTK (0.66) | HDAC1MTORBTKEGFRLCK | |
| SCHEMBL28473150 | 0.93 | BTK (0.68) | HDAC1MTORBTKEGFRLCK | |
| SCHEMBL28927671 | 0.90 | BTK (0.61) | HDAC1MTORBTKEGFRLCK | |
| SCHEMBL30172761 | 0.90 | BTK (0.61) | HDAC1MTORBTKEGFRLCK | |
| SCHEMBL29201401 | 0.89 | BTK (0.61) | HDAC1MTORBTKEGFRLCK | |
| SCHEMBL28468967 | 0.87 | BTK (0.65) | BTKEGFRLCKJAK3ITK | |
| SCHEMBL30172745 | 0.86 | BTK (0.62) | HDAC1MTORBTKEGFRLCK | |
| SCHEMBL28927570 | 0.86 | BTK (0.62) | HDAC1MTORBTKEGFRLCK | |
| SCHEMBL15916593 | 0.83 | BTK (0.67) | BTKEGFRLCKJAK3ITK |
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 |