Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FOLR1 | P15328 | 12/20 | 0.75 |
| ▸ | SLC46A1 | Q96NT5 | 8/20 | 0.75 |
| ▸ | SLC19A1 | P41440 | 7/20 | 0.75 |
| ▸ | GART | P22102 | 9/20 | 0.68 |
| ▸ | DHFR | P00374 | 5/20 | 0.60 |
| ▸ | TYMS | P04818 | 3/20 | 0.60 |
| ▸ | FOLR2 | P14207 | 5/20 | 0.53 |
| ▸ | ATIC | P31939 | 5/20 | 0.53 |
| ▸ | SHMT1 | P34896 | 3/20 | 0.53 |
| ▸ | FRK | P42685 | 1/20 | 0.53 |
| ▸ | SHMT2 | P34897 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9439759 | 1.00 | FOLR1 (0.75) | FOLR1SLC46A1SLC19A1GARTDHFR | |
| SCHEMBL9228411 | 0.97 | FOLR1 (0.71) | FOLR1SLC46A1SLC19A1GARTDHFR | |
| SCHEMBL9221924 | 0.97 | FOLR1 (0.71) | FOLR1SLC46A1SLC19A1GARTDHFR | |
| SCHEMBL9439758 | 0.95 | FOLR1 (0.76) | FOLR1SLC46A1SLC19A1GARTDHFR | |
| SCHEMBL9439728 | 0.95 | FOLR1 (0.76) | FOLR1SLC46A1SLC19A1GARTDHFR | |
| SCHEMBL9439839 | 0.92 | FOLR1 (0.74) | FOLR1SLC46A1SLC19A1GARTDHFR | |
| SCHEMBL9221180 | 0.92 | FOLR1 (0.71) | FOLR1SLC46A1SLC19A1GARTDHFR | |
| SCHEMBL9225829 | 0.89 | FOLR1 (0.70) | FOLR1SLC46A1SLC19A1GARTDHFR | |
| SCHEMBL9224206 | 0.89 | FOLR1 (0.70) | FOLR1SLC46A1SLC19A1GARTDHFR | |
| SCHEMBL9042341 | 0.87 | DHFR (0.58) | FOLR1SLC46A1SLC19A1GARTDHFR |
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-5354754-A | Antitumor and -carcinogenic agents; treating human epidermoid carcinoma KB | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1994-10-11 | — | — | US | disclosed |
| EP-0418924-A2 | Pyrrolopyrimidines, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1991-03-27 | — | — | EP | disclosed |