Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FOLR2 | P14207 | 1/20 | 0.49 |
| ▸ | FOLR1 | P15328 | 1/20 | 0.49 |
| ▸ | ATIC | P31939 | 1/20 | 0.49 |
| ▸ | DHFR | P00374 | 9/20 | 0.46 |
| ▸ | MTR | Q99707 | 1/20 | 0.46 |
| ▸ | TYMS | P04818 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8568731 | 0.95 | DHFR (0.47) | FOLR2FOLR1ATICDHFRMTR | |
| SCHEMBL9001930 | 0.93 | ATIC (0.48) | FOLR2FOLR1ATICDHFRMTR | |
| SCHEMBL9001791 | 0.88 | ATIC (0.46) | FOLR2FOLR1ATICDHFRMTR | |
| SCHEMBL1066004 | 0.87 | DHFR (0.59) | ATICDHFRMTR | |
| SCHEMBL8563180 | 0.84 | FOLR1 (0.51) | FOLR2FOLR1ATICDHFRMTR | |
| SCHEMBL8571475 | 0.84 | DHFR (0.57) | DHFRMTR | |
| SCHEMBL9001799 | 0.80 | DHFR (0.54) | ATICDHFRMTRTYMS | |
| SCHEMBL8571393 | 0.77 | ATIC (0.59) | ATICDHFRMTR | |
| SCHEMBL9001769 | 0.77 | FOLR1 (0.49) | FOLR2FOLR1ATIC | |
| SCHEMBL8603963 | 0.77 | DHFR (0.55) | DHFRMTR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0530579-B1 | Condensed pyrimidine derivatives antitumor agents | EISAI CO LTD (JP) | 1998-11-11 | — | — | EP | disclosed |
| 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 |