Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 19/20 | 0.64 |
| ▸ | LCK | P06239 | 7/20 | 0.64 |
| ▸ | ITK | Q08881 | 6/20 | 0.64 |
| ▸ | EGFR | P00533 | 5/20 | 0.64 |
| ▸ | JAK3 | P52333 | 4/20 | 0.64 |
| ▸ | NUDT14 | O95848 | 1/20 | 0.57 |
| ▸ | NUDT5 | Q9UKK9 | 1/20 | 0.57 |
| ▸ | FYN | P06241 | 4/20 | 0.53 |
| ▸ | LYN | P07948 | 4/20 | 0.53 |
| ▸ | SRC | P12931 | 4/20 | 0.53 |
| ▸ | FLT3 | P36888 | 4/20 | 0.53 |
| ▸ | PTK6 | Q13882 | 4/20 | 0.53 |
| ▸ | HCK | P08631 | 3/20 | 0.53 |
| ▸ | FGR | P09769 | 3/20 | 0.53 |
| ▸ | MAP2K1 | Q02750 | 3/20 | 0.53 |
| ▸ | BRAF | P15056 | 3/20 | 0.53 |
| ▸ | YES1 | P07947 | 2/20 | 0.53 |
| ▸ | BLK | P51451 | 2/20 | 0.53 |
| ▸ | BMX | P51813 | 2/20 | 0.53 |
| ▸ | MAP2K5 | Q13163 | 2/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL30172740 | 1.00 | BTK (0.64) | BTKLCKITKEGFRJAK3 | |
| SCHEMBL28927570 | 0.95 | BTK (0.62) | BTKLCKITKEGFRJAK3 | |
| SCHEMBL30172745 | 0.95 | BTK (0.62) | BTKLCKITKEGFRJAK3 | |
| SCHEMBL29201401 | 0.94 | BTK (0.61) | BTKLCKITKEGFRJAK3 | |
| SCHEMBL28927671 | 0.93 | BTK (0.61) | BTKLCKITKEGFRJAK3 | |
| SCHEMBL30172761 | 0.93 | BTK (0.61) | BTKLCKITKEGFRJAK3 | |
| SCHEMBL28473150 | 0.89 | BTK (0.68) | BTKLCKITKEGFRJAK3 | |
| SCHEMBL28415528 | 0.86 | BTK (0.69) | BTKLCKITKEGFRJAK3 | |
| SCHEMBL28477160 | 0.83 | BTK (0.66) | BTKLCKITKEGFRJAK3 | |
| SCHEMBL13861437 | 0.82 | BTK (0.72) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115572297-B | Pyrazolopyrimidine-containing o-phenylenediamine derivative, and preparation method and application thereof | 山东大学 | 2024-04-26 | — | — | CN | disclosed |
| CN-115572297-A | O-phenylenediamine derivative containing pyrazolopyrimidine and preparation method and application thereof | 山东大学 | 2023-01-06 | — | — | CN | disclosed |