Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 3/20 | 0.46 |
| ▸ | PKMYT1 | Q99640 | 2/20 | 0.45 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.45 |
| ▸ | SYK | P43405 | 2/20 | 0.44 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.43 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.43 |
| ▸ | PLK1 | P53350 | 1/20 | 0.42 |
| ▸ | LRRK2 | Q5S007 | 6/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL21600790 | 0.83 | MAPK3 (0.52) | EGFRALK | |
| SCHEMBL21600780 | 0.82 | GSK3B (0.45) | EGFRSYKPLK1LRRK2KDM4E | |
| SCHEMBL21596345 | 0.76 | SYK (0.42) | EGFRPKMYT1SLC2A1SYKPLK1 | |
| SCHEMBL30331091 | 0.76 | PKMYT1 (0.43) | EGFRPKMYT1SLC2A1PLK1LRRK2 | |
| SCHEMBL30379421 | 0.75 | CDK1 (0.54) | EGFRPKMYT1SLC2A1SYKLRRK2 | |
| SCHEMBL28532418 | 0.75 | CDK1 (0.54) | EGFRPKMYT1SLC2A1SYKLRRK2 | |
| SCHEMBL28953583 | 0.72 | EGFR (0.49) | EGFRPKMYT1SLC2A1PLK1LRRK2 | |
| SCHEMBL28540649 | 0.72 | SLC2A1 (0.66) | EGFRPKMYT1SLC2A1SYKPLK1 | |
| SCHEMBL30378896 | 0.72 | SLC2A1 (0.66) | EGFRPKMYT1SLC2A1SYKPLK1 | |
| SCHEMBL28910563 | 0.72 | SLC2A1 (0.48) | PKMYT1SLC2A1SYKMAPK8MAPK9 |
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-112313207-B | Cyano-substituted pyridine and cyano-substituted pyrimidine compounds, and preparation methods and applications thereof | 北京赛特明强医药科技有限公司 | 2023-02-14 | — | — | CN | disclosed |
| CN-112313207-A | Cyano-substituted pyridine and cyano-substituted pyrimidine compounds, and preparation methods and applications thereof | 北京赛特明强医药科技有限公司 | 2021-02-02 | — | — | CN | disclosed |