Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 16/20 | 0.50 |
| ▸ | ACHE | P22303 | 1/20 | 0.49 |
| ▸ | BACE1 | P56817 | 1/20 | 0.49 |
| ▸ | SRC | P12931 | 3/20 | 0.48 |
| ▸ | ITK | Q08881 | 4/20 | 0.46 |
| ▸ | JAK3 | P52333 | 3/20 | 0.46 |
| ▸ | LCK | P06239 | 3/20 | 0.46 |
| ▸ | EGFR | P00533 | 2/20 | 0.46 |
| ▸ | FGR | P09769 | 2/20 | 0.45 |
| ▸ | FLT3 | P36888 | 2/20 | 0.45 |
| ▸ | CSK | P41240 | 2/20 | 0.45 |
| ▸ | BLK | P51451 | 2/20 | 0.45 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.45 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.45 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.45 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.45 |
| ▸ | PRKDC | P78527 | 1/20 | 0.45 |
| ▸ | FYN | P06241 | 1/20 | 0.43 |
| ▸ | YES1 | P07947 | 1/20 | 0.43 |
| ▸ | LYN | P07948 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28409003 | 0.92 | BTK (0.55) | BTKACHEBACE1SRCITK | |
| SCHEMBL28414201 | 0.91 | BTK (0.59) | BTKACHEBACE1SRCITK | |
| SCHEMBL28403345 | 0.89 | BTK (0.53) | BTKSRCITKJAK3LCK | |
| SCHEMBL28407416 | 0.89 | BTK (0.53) | BTKACHEBACE1SRCITK | |
| SCHEMBL28409178 | 0.87 | BTK (0.51) | BTKSRCITKJAK3LCK | |
| SCHEMBL28403856 | 0.87 | BTK (0.51) | BTKSRCITKJAK3LCK | |
| SCHEMBL28409197 | 0.85 | BTK (0.54) | BTKSRCITKJAK3LCK | |
| SCHEMBL28407374 | 0.84 | BTK (0.58) | BTKSRCITKJAK3LCK | |
| SCHEMBL28414191 | 0.83 | BTK (0.50) | BTKSRCITKJAK3LCK | |
| SCHEMBL28890946 | 0.83 | BTK (0.65) | BTKACHEBACE1SRCITK |
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-111196813-B | 1,3, 4-trisubstituted pyrazolopyrimidine compound as well as preparation method and application thereof | 山东大学 | 2021-10-26 | — | — | CN | disclosed |
| CN-111196813-A | 1,3, 4-trisubstituted pyrazolopyrimidine compound as well as preparation method and application thereof | 山东大学 | 2020-05-26 | — | — | CN | disclosed |