Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATIC | P31939 | 14/20 | 0.69 |
| ▸ | SHMT1 | P34896 | 14/20 | 0.69 |
| ▸ | SHMT2 | P34897 | 14/20 | 0.69 |
| ▸ | GART | P22102 | 13/20 | 0.69 |
| ▸ | FOLR1 | P15328 | 3/20 | 0.51 |
| ▸ | DHFR | P00374 | 1/20 | 0.51 |
| ▸ | TYMS | P04818 | 1/20 | 0.51 |
| ▸ | SLC19A1 | P41440 | 1/20 | 0.49 |
| ▸ | SLC46A1 | Q96NT5 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL9001790 | 0.93 | ATIC (0.73) | ATICSHMT1SHMT2GARTFOLR1 | |
| SCHEMBL9001782 | 0.90 | ATIC (0.68) | ATICSHMT1SHMT2GARTFOLR1 | |
| SCHEMBL9001758 | 0.88 | ATIC (0.53) | ATICSHMT1SHMT2GARTFOLR1 | |
| SCHEMBL9001827 | 0.86 | ATIC (0.71) | ATICSHMT1SHMT2GARTFOLR1 | |
| SCHEMBL8569042 | 0.86 | ATIC (0.51) | ATICSHMT1SHMT2GARTDHFR | |
| SCHEMBL8569034 | 0.86 | ATIC (0.51) | ATICSHMT1SHMT2GARTDHFR | |
| SCHEMBL9001846 | 0.85 | ATIC (0.71) | ATICSHMT1SHMT2GARTDHFR | |
| SCHEMBL9001842 | 0.84 | ATIC (0.64) | ATICSHMT1SHMT2GARTFOLR1 | |
| SCHEMBL9001860 | 0.83 | ATIC (0.71) | ATICSHMT1SHMT2GARTFOLR1 | |
| SCHEMBL9001824 | 0.83 | ATIC (0.91) | ATICSHMT1SHMT2GARTFOLR1 |
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 |