Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 20/20 | 0.67 |
| ▸ | EGFR | P00533 | 4/20 | 0.66 |
| ▸ | NUDT14 | O95848 | 2/20 | 0.64 |
| ▸ | NUDT5 | Q9UKK9 | 2/20 | 0.64 |
| ▸ | LCK | P06239 | 3/20 | 0.63 |
| ▸ | LYN | P07948 | 3/20 | 0.63 |
| ▸ | SRC | P12931 | 2/20 | 0.62 |
| ▸ | KDR | P35968 | 2/20 | 0.62 |
| ▸ | TEK | Q02763 | 1/20 | 0.62 |
| ▸ | TEC | P42680 | 3/20 | 0.62 |
| ▸ | BMX | P51813 | 3/20 | 0.62 |
| ▸ | TXK | P42681 | 2/20 | 0.62 |
| ▸ | FGFR2 | P21802 | 2/20 | 0.62 |
| ▸ | ITK | Q08881 | 2/20 | 0.62 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.62 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.62 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.62 |
| ▸ | LATS1 | O95835 | 1/20 | 0.62 |
| ▸ | ABL1 | P00519 | 1/20 | 0.62 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL29439245 | 1.00 | BTK (0.67) | BTKEGFRNUDT14NUDT5LCK | |
| SCHEMBL29439163 | 0.97 | BTK (0.67) | BTKEGFRNUDT14NUDT5LCK | |
| SCHEMBL28638034 | 0.97 | BTK (0.67) | BTKEGFRNUDT14NUDT5LCK | |
| SCHEMBL28647621 | 0.96 | BTK (0.70) | BTKEGFRNUDT14NUDT5LCK | |
| SCHEMBL28648851 | 0.96 | BTK (0.70) | BTKEGFRNUDT14NUDT5LCK | |
| SCHEMBL29439221 | 0.94 | BTK (0.71) | BTKEGFRNUDT14NUDT5LCK | |
| SCHEMBL29439079 | 0.94 | BTK (0.71) | BTKEGFRNUDT14NUDT5LCK | |
| SCHEMBL29439099 | 0.94 | BTK (0.73) | BTKEGFRNUDT14NUDT5LCK | |
| SCHEMBL29069290 | 0.94 | BTK (0.73) | BTKEGFRNUDT14NUDT5LCK | |
| SCHEMBL29439343 | 0.94 | BTK (0.70) | BTKEGFRNUDT14NUDT5LCK |
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-113544130-A | BTK inhibitor ring derivative, preparation method and pharmaceutical application thereof | 四川海思科制药有限公司 | 2021-10-22 | — | — | CN | disclosed |
| WO-2020239103-A1 | BTK INHIBITOR RING DERIVATIVE, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL APPLICATION THEREOF | 四川海思科制药有限公司 | 2020-12-03 | — | — | WO | disclosed |