Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 18/20 | 0.57 |
| ▸ | EGFR | P00533 | 14/20 | 0.57 |
| ▸ | SRC | P12931 | 5/20 | 0.57 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.48 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.48 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL17447870 | 1.00 | BTK (0.57) | BTKEGFRSRCFGFR1FGFR4 | |
| SCHEMBL28392787 | 0.97 | BTK (0.57) | BTKEGFRSRCFGFR1FGFR4 | |
| SCHEMBL17447874 | 0.97 | BTK (0.57) | BTKEGFRSRCFGFR1FGFR4 | |
| SCHEMBL17447830 | 0.90 | BTK (0.58) | BTKEGFRSRCFGFR1FGFR4 | |
| SCHEMBL17447879 | 0.89 | BTK (0.58) | BTKEGFRSRCFGFR1FGFR4 | |
| SCHEMBL17447843 | 0.89 | BTK (0.58) | BTKEGFRSRCFGFR1FGFR4 | |
| SCHEMBL28389981 | 0.89 | BTK (0.58) | BTKEGFRSRCFGFR1FGFR4 | |
| SCHEMBL17447850 | 0.89 | BTK (0.58) | BTKEGFRSRCFGFR1FGFR4 | |
| SCHEMBL17447806 | 0.89 | BTK (0.58) | BTKEGFRSRCFGFR1FGFR4 | |
| SCHEMBL17447837 | 0.88 | BTK (0.54) | BTKEGFRSRCFGFR1FGFR4 |
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-106687446-B | 5-amino-4-carbamoyl-pyrazole compounds as selective and irreversible kinase inhibitors of T790M/WT-EGFR and uses thereof | 百济神州(北京)生物科技有限公司 | 2020-04-28 | — | — | CN | disclosed |