Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 8/20 | 1.00 |
| ▸ | FGFR1 | P11362 | 4/20 | 1.00 |
| ▸ | ABL1 | P00519 | 2/20 | 0.55 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.55 |
| ▸ | KIT | P10721 | 1/20 | 0.55 |
| ▸ | SRC | P12931 | 1/20 | 0.55 |
| ▸ | BRAF | P15056 | 1/20 | 0.55 |
| ▸ | KDR | P35968 | 1/20 | 0.55 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.55 |
| ▸ | TEK | Q02763 | 1/20 | 0.55 |
| ▸ | LCK | P06239 | 5/20 | 0.53 |
| ▸ | NPC1 | O15118 | 4/20 | 0.46 |
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.46 |
| ▸ | RELA | Q04206 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | ERBB3 | P21860 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL374328 | 0.85 | EGFR (0.74) | EGFRFGFR1ABL1PDGFRBKIT | |
| SCHEMBL379004 | 0.80 | EGFR (0.69) | EGFRFGFR1ABL1PDGFRBKIT | |
| SCHEMBL28261624 | 0.80 | EGFR (1.00) | EGFRFGFR1ABL1PDGFRBKIT | |
| SCHEMBL374014 | 0.78 | EGFR (0.66) | EGFRFGFR1ABL1PDGFRBKIT | |
| SCHEMBL28503748 | 0.78 | EGFR (0.66) | EGFRFGFR1ABL1PDGFRBKIT | |
| SCHEMBL28514560 | 0.78 | EGFR (0.64) | EGFRFGFR1ABL1PDGFRBKIT | |
| SCHEMBL374526 | 0.75 | EGFR (0.69) | EGFRFGFR1ABL1PDGFRBKIT | |
| SCHEMBL374173 | 0.75 | EGFR (0.75) | EGFRFGFR1ABL1PDGFRBKIT | |
| SCHEMBL377191 | 0.74 | EGFR (0.61) | EGFRFGFR1ABL1PDGFRBKIT | |
| SCHEMBL28516203 | 0.74 | EGFR (0.61) | EGFRFGFR1ABL1PDGFRBKIT |
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-109053593-B | 1- (2, 6-chlorphenyl) -3- (substituted pyrimidine-4-yl) urea compound and preparation and application thereof | 温州医科大学 | 2020-12-04 | — | — | CN | disclosed |