Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 13/20 | 0.54 |
| ▸ | MTR | Q99707 | 1/20 | 0.53 |
| ▸ | TYMS | P04818 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL6699116 | 0.94 | DHFR (0.61) | DHFRMTRTYMS | |
| SCHEMBL10647855 | 0.93 | DHFR (0.56) | DHFRMTRTYMSCA2CA1 | |
| SCHEMBL10652925 | 0.90 | DHFR (0.58) | DHFRMTRTYMSCA2CA1 | |
| SCHEMBL6701864 | 0.87 | DHFR (0.59) | DHFRMTRTYMS | |
| SCHEMBL6697447 | 0.84 | DHFR (0.54) | DHFRMTR | |
| SCHEMBL6704122 | 0.83 | DHFR (0.66) | DHFRMTRTYMS | |
| SCHEMBL6701226 | 0.79 | DHFR (0.73) | DHFR | |
| SCHEMBL6699847 | 0.78 | DHFR (0.52) | DHFRMTR | |
| SCHEMBL6705312 | 0.76 | DHFR (0.49) | DHFRMTR | |
| SCHEMBL11125686 | 0.73 | DHFR (0.57) | DHFRMTRTYMS |
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 |
|---|---|---|---|---|---|---|---|
| EP-0103464-B1 | DIAMINOPYRIMIDINES AND THEIR PRODUCTION | WARNER-LAMBERT COMPANY (US) | 1988-11-17 | — | — | EP | claimed |