Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 20/20 | 0.63 |
| ▸ | NUDT14 | O95848 | 1/20 | 0.63 |
| ▸ | NUDT5 | Q9UKK9 | 1/20 | 0.63 |
| ▸ | EGFR | P00533 | 5/20 | 0.61 |
| ▸ | LCK | P06239 | 6/20 | 0.60 |
| ▸ | LYN | P07948 | 2/20 | 0.60 |
| ▸ | SRC | P12931 | 2/20 | 0.58 |
| ▸ | KDR | P35968 | 1/20 | 0.58 |
| ▸ | TEK | Q02763 | 1/20 | 0.58 |
| ▸ | ITK | Q08881 | 4/20 | 0.58 |
| ▸ | ABL1 | P00519 | 1/20 | 0.57 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.57 |
| ▸ | FYN | P06241 | 1/20 | 0.57 |
| ▸ | YES1 | P07947 | 1/20 | 0.57 |
| ▸ | HCK | P08631 | 1/20 | 0.57 |
| ▸ | FGR | P09769 | 1/20 | 0.57 |
| ▸ | FER | P16591 | 1/20 | 0.57 |
| ▸ | CSK | P41240 | 1/20 | 0.57 |
| ▸ | TEC | P42680 | 1/20 | 0.57 |
| ▸ | BLK | P51451 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL30172757 | 1.00 | BTK (0.63) | BTKNUDT14NUDT5EGFRLCK | |
| SCHEMBL28927612 | 1.00 | BTK (0.63) | BTKNUDT14NUDT5EGFRLCK | |
| SCHEMBL30172752 | 0.98 | BTK (0.62) | BTKNUDT14NUDT5EGFRLCK | |
| SCHEMBL30172758 | 0.97 | BTK (0.62) | BTKNUDT14NUDT5EGFRLCK | |
| SCHEMBL28927572 | 0.97 | BTK (0.62) | BTKNUDT14NUDT5EGFRLCK | |
| SCHEMBL30172753 | 0.94 | BTK (0.60) | BTKNUDT14NUDT5EGFRLCK | |
| SCHEMBL28927589 | 0.93 | BTK (0.60) | BTKNUDT14NUDT5EGFRLCK | |
| SCHEMBL30172747 | 0.93 | BTK (0.60) | BTKNUDT14NUDT5EGFRLCK | |
| SCHEMBL28927585 | 0.91 | BTK (0.65) | BTKNUDT14NUDT5EGFRLCK | |
| SCHEMBL28474049 | 0.91 | BTK (0.67) | BTKNUDT14NUDT5EGFRLCK |
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 |