Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATIC | P31939 | 15/20 | 0.68 |
| ▸ | SHMT1 | P34896 | 14/20 | 0.68 |
| ▸ | SHMT2 | P34897 | 14/20 | 0.68 |
| ▸ | GART | P22102 | 11/20 | 0.67 |
| ▸ | DHFR | P00374 | 3/20 | 0.54 |
| ▸ | TYMS | P04818 | 1/20 | 0.54 |
| ▸ | FOLR2 | P14207 | 1/20 | 0.48 |
| ▸ | FOLR1 | P15328 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL9001842 | 0.93 | ATIC (0.64) | ATICSHMT1SHMT2GARTDHFR | |
| SCHEMBL9001757 | 0.91 | ATIC (0.66) | ATICSHMT1SHMT2GARTDHFR | |
| SCHEMBL9001815 | 0.88 | ATIC (0.52) | ATICSHMT1SHMT2GARTDHFR | |
| SCHEMBL9001806 | 0.87 | ATIC (0.72) | ATICSHMT1SHMT2GARTDHFR | |
| SCHEMBL9001772 | 0.86 | ATIC (0.63) | ATICSHMT1SHMT2GARTDHFR | |
| SCHEMBL8571085 | 0.86 | ATIC (0.49) | ATICSHMT1SHMT2GARTDHFR | |
| SCHEMBL8571094 | 0.86 | ATIC (0.49) | ATICSHMT1SHMT2GARTDHFR | |
| SCHEMBL9001756 | 0.85 | ATIC (0.78) | ATICSHMT1SHMT2GARTDHFR | |
| SCHEMBL9001850 | 0.85 | ATIC (0.75) | ATICSHMT1SHMT2GARTDHFR | |
| SCHEMBL9001790 | 0.84 | ATIC (0.73) | ATICSHMT1SHMT2GARTDHFR |
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 |
|---|---|---|---|---|---|---|---|
| US-5554615-A | ANTITUMOR | EISAI CO., LTD. (JP) | 1996-09-10 | — | — | US | disclosed |
| EP-0530579-A1 | Condensed pyrimidine derivatives antitumor agents | Eisai Co., Ltd. (JP) | 1993-03-10 | — | — | EP | disclosed |