Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 7/20 | 0.56 |
| ▸ | TGFBR1 | P36897 | 8/20 | 0.53 |
| ▸ | ACVR1 | Q04771 | 9/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL17907560 | 1.00 | DHFR (0.56) | DHFRTGFBR1ACVR1HRH3 | |
| SCHEMBL14694265 | 0.85 | DHFR (0.58) | DHFR | |
| SCHEMBL2558872 | 0.84 | DHFR (0.60) | DHFR | |
| SCHEMBL30560046 | 0.83 | DHFR (0.59) | DHFR | |
| SCHEMBL265154 | 0.83 | DHFR (0.59) | DHFR | |
| SCHEMBL2563804 | 0.82 | DHFR (0.46) | DHFR | |
| SCHEMBL1199578 | 0.80 | TGFBR1 (0.55) | TGFBR1ACVR1 | |
| SCHEMBL14694244 | 0.78 | DHFR (0.50) | DHFR | |
| SCHEMBL9167447 | 0.77 | DHFR (0.59) | DHFRHRH3 | |
| SCHEMBL30515507 | 0.75 | FLT3 (0.45) | TGFBR1ACVR1 |
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-116514779-A | 2, 4-disubstituted-5-fluoropyrimidine derivative and preparation method and application thereof | 中南大学 | 2023-08-01 | — | — | CN | disclosed |