Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 2/20 | 0.47 |
| ▸ | BTK | Q06187 | 3/20 | 0.46 |
| ▸ | WEE1 | P30291 | 8/20 | 0.46 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.44 |
| ▸ | STK17B | O94768 | 2/20 | 0.44 |
| ▸ | STK17A | Q9UEE5 | 2/20 | 0.44 |
| ▸ | ALK | Q9UM73 | 4/20 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL29052364 | 0.99 | NTRK1 (0.46) | NTRK1BTKWEE1PTK2STK17B | |
| Hydrochloric Acid SCHEMBL29051911 | 0.81 | PTK2 (0.51) | BTKPTK2STK17BSTK17AALK | |
| SCHEMBL29051912 | 0.80 | PTK2 (0.49) | BTKWEE1PTK2STK17BSTK17A | |
| Hydrochloric Acid SCHEMBL29051798 | 0.80 | PTK2 (0.47) | NTRK1BTKWEE1PTK2STK17B | |
| SCHEMBL30468470 | 0.80 | PTK2 (0.47) | NTRK1BTKWEE1PTK2STK17B | |
| Hydrochloric Acid SCHEMBL29051677 | 0.79 | PTK2 (0.46) | NTRK1BTKWEE1PTK2STK17B | |
| SCHEMBL29051801 | 0.79 | PTK2 (0.50) | NTRK1BTKPTK2STK17AALK | |
| SCHEMBL30468492 | 0.79 | BRD4 (0.53) | NTRK1BTKWEE1PTK2 | |
| Hydrochloric Acid SCHEMBL29052418 | 0.78 | BRD4 (0.52) | NTRK1BTKWEE1PTK2 | |
| Hydrochloric Acid SCHEMBL29051788 | 0.75 | BTK (0.45) | BTKWEE1PTK2STK17BSTK17A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116332910-A | 2-aminopyrimidine derivatives as kinase inhibitors, preparation and use thereof | 江苏威凯尔医药科技有限公司 | 2023-06-27 | — | — | CN | disclosed |