Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 7/20 | 0.47 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.44 |
| ▸ | RAC1 | P63000 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 4/20 | 0.41 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.39 |
| ▸ | RAF1 | P04049 | 1/20 | 0.39 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.39 |
| ▸ | KIT | P10721 | 1/20 | 0.39 |
| ▸ | BRAF | P15056 | 1/20 | 0.39 |
| ▸ | TEK | Q02763 | 1/20 | 0.39 |
| ▸ | PLK4 | O00444 | 1/20 | 0.39 |
| ▸ | TDO2 | P48775 | 1/20 | 0.38 |
| ▸ | FLT3 | P36888 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | JAK3 | P52333 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | BCR | P11274 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30213605 | 0.94 | EGFR (0.45) | EGFRCSNK2A1KDRFGFR1RAF1 | |
| SCHEMBL28549641 | 0.84 | EGFR (0.41) | EGFRKDRTDO2JAK2JAK3 | |
| SCHEMBL30213776 | 0.83 | EGFR (0.55) | EGFRCSNK2A1RAC1KDRFLT3 | |
| SCHEMBL30213714 | 0.80 | EGFR (0.49) | EGFRCSNK2A1RAC1ABL1BCR | |
| SCHEMBL30213751 | 0.79 | EGFR (0.49) | EGFRKDRFGFR1RAF1PDGFRB | |
| SCHEMBL28546217 | 0.76 | EGFR (0.46) | EGFRCSNK2A1KDRBRAFTDO2 | |
| SCHEMBL28546210 | 0.74 | EGFR (0.48) | EGFRCSNK2A1KDRBRAFTDO2 | |
| SCHEMBL30213859 | 0.74 | EGFR (0.57) | EGFR | |
| SCHEMBL30213858 | 0.72 | EGFR (0.49) | EGFRKDRFGFR1RAF1PDGFRB | |
| SCHEMBL15522255 | 0.67 | ROCK1 (0.49) | EGFRCSNK2A1KDRFGFR1PDGFRB |
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-112574177-B | Pyrimidine derivatives and application thereof in preparing antitumor drugs | 陕西师范大学 | 2023-01-31 | — | — | CN | disclosed |