Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK3 | P52333 | 13/20 | 0.71 |
| ▸ | EGFR | P00533 | 6/20 | 0.58 |
| ▸ | JAK2 | O60674 | 3/20 | 0.58 |
| ▸ | FLT3 | P36888 | 3/20 | 0.58 |
| ▸ | BLK | P51451 | 3/20 | 0.58 |
| ▸ | BTK | Q06187 | 2/20 | 0.58 |
| ▸ | ITK | Q08881 | 2/20 | 0.58 |
| ▸ | JAK1 | P23458 | 1/20 | 0.58 |
| ▸ | TTK | P33981 | 1/20 | 0.58 |
| ▸ | TXK | P42681 | 1/20 | 0.58 |
| ▸ | SRC | P12931 | 2/20 | 0.53 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.52 |
| ▸ | CTSC | P53634 | 2/20 | 0.52 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.52 |
| ▸ | PLK4 | O00444 | 1/20 | 0.52 |
| ▸ | GAK | O14976 | 1/20 | 0.52 |
| ▸ | NUAK1 | O60285 | 1/20 | 0.52 |
| ▸ | BMX | P51813 | 1/20 | 0.52 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.52 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL21601019 | 0.94 | JAK3 (0.66) | JAK3EGFRJAK2FLT3BLK | |
| SCHEMBL21601013 | 0.91 | JAK3 (0.63) | JAK3EGFRJAK2FLT3BLK | |
| SCHEMBL21600962 | 0.89 | JAK3 (0.56) | JAK3EGFRJAK2FLT3BLK | |
| SCHEMBL21601004 | 0.86 | JAK3 (0.61) | JAK3EGFRJAK2FLT3BLK | |
| SCHEMBL21601023 | 0.86 | JAK3 (0.71) | JAK3EGFRJAK2FLT3BLK | |
| SCHEMBL21601005 | 0.86 | JAK3 (0.71) | JAK3EGFRJAK2FLT3BLK | |
| SCHEMBL21601022 | 0.83 | JAK3 (0.68) | JAK3EGFRJAK2FLT3BLK | |
| SCHEMBL17209856 | 0.83 | JAK3 (1.00) | JAK3EGFRJAK2FLT3BLK | |
| SCHEMBL21601024 | 0.83 | JAK3 (0.51) | JAK3EGFRJAK2FLT3BLK | |
| SCHEMBL21601021 | 0.82 | MAP3K7 (0.59) | JAK3EGFRFLT3SRC |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019242689-A1 | CYANO-SUBSTITUTED PYRIDINE AND CYANO-SUBSTITUTED PYRIMIDINE COMPOUND, AND PREPARATION METHOD AND APPLICATION THEREOF | 北京赛特明强医药科技有限公司 | 2019-12-26 | — | — | WO | disclosed |