Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 8/20 | 0.53 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.52 |
| ▸ | TEC | P42680 | 1/20 | 0.52 |
| ▸ | TXK | P42681 | 1/20 | 0.52 |
| ▸ | BMX | P51813 | 1/20 | 0.52 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.52 |
| ▸ | RET | P07949 | 1/20 | 0.48 |
| ▸ | SRC | P12931 | 2/20 | 0.48 |
| ▸ | PIK3CD | O00329 | 3/20 | 0.47 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.47 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.47 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.47 |
| ▸ | PRKDC | P78527 | 2/20 | 0.47 |
| ▸ | MTOR | P42345 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | FYN | P06241 | 3/20 | 0.47 |
| ▸ | LYN | P07948 | 1/20 | 0.45 |
| ▸ | BLK | P51451 | 1/20 | 0.45 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28380136 | 0.92 | BTK (0.55) | BTKERBB2TECTXKBMX | |
| SCHEMBL28384506 | 0.90 | BTK (0.53) | BTKERBB2TECTXKBMX | |
| SCHEMBL28387491 | 0.90 | BTK (0.61) | BTKERBB2TECTXKBMX | |
| SCHEMBL28383126 | 0.89 | HDAC1 (0.46) | BTKERBB2TECTXKBMX | |
| SCHEMBL28384616 | 0.88 | BTK (0.59) | BTKERBB2TECTXKBMX | |
| SCHEMBL28384517 | 0.87 | BTK (0.56) | BTK | |
| SCHEMBL28469754 | 0.87 | MTOR (0.62) | BTKERBB2TECTXKBMX | |
| SCHEMBL28381025 | 0.87 | BTK (0.51) | BTKERBB2TECTXKBMX | |
| SCHEMBL30172742 | 0.85 | BTK (0.52) | BTKERBB2TECTXKBMX | |
| SCHEMBL28471958 | 0.84 | BTK (0.56) | BTKERBB2TECTXKBMX |
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-111018865-A | 1-substituted benzyl pyrazolopyrimidine derivative and preparation method and application thereof | 山东大学 | 2020-04-17 | — | — | CN | claimed |
| CN-111018865-B | 1-substituted benzyl pyrazolopyrimidine derivative and preparation method and application thereof | 山东大学 | 2021-01-15 | — | — | CN | disclosed |
| CN-111018865-A | 1-substituted benzyl pyrazolopyrimidine derivative and preparation method and application thereof | 山东大学 | 2020-04-17 | — | — | CN | disclosed |