Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATIC | P31939 | 16/20 | 0.72 |
| ▸ | SHMT1 | P34896 | 14/20 | 0.72 |
| ▸ | SHMT2 | P34897 | 14/20 | 0.72 |
| ▸ | GART | P22102 | 12/20 | 0.71 |
| ▸ | FOLR2 | P14207 | 1/20 | 0.59 |
| ▸ | FOLR1 | P15328 | 1/20 | 0.59 |
| ▸ | DHFR | P00374 | 3/20 | 0.55 |
| ▸ | TYMS | P04818 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL9001756 | 0.95 | ATIC (0.78) | ATICSHMT1SHMT2GARTFOLR2 | |
| SCHEMBL9001793 | 0.87 | ATIC (0.56) | ATICSHMT1SHMT2GARTFOLR2 | |
| SCHEMBL9001784 | 0.87 | ATIC (0.90) | ATICSHMT1SHMT2GARTFOLR2 | |
| SCHEMBL9001820 | 0.87 | ATIC (0.68) | ATICSHMT1SHMT2GARTFOLR2 | |
| SCHEMBL9001757 | 0.85 | ATIC (0.66) | ATICSHMT1SHMT2GARTFOLR2 | |
| SCHEMBL8568309 | 0.85 | ATIC (0.53) | ATICSHMT1SHMT2GARTFOLR2 | |
| SCHEMBL8568317 | 0.85 | ATIC (0.53) | ATICSHMT1SHMT2GARTFOLR2 | |
| SCHEMBL9001845 | 0.85 | ATIC (0.65) | ATICSHMT1SHMT2GARTFOLR2 | |
| SCHEMBL9001842 | 0.84 | ATIC (0.64) | ATICSHMT1SHMT2GARTFOLR2 | |
| SCHEMBL9001800 | 0.84 | ATIC (1.00) | ATICSHMT1SHMT2GARTFOLR2 |
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 |