Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FOLR1 | P15328 | 13/20 | 0.75 |
| ▸ | SLC46A1 | Q96NT5 | 9/20 | 0.75 |
| ▸ | SLC19A1 | P41440 | 6/20 | 0.75 |
| ▸ | GART | P22102 | 11/20 | 0.72 |
| ▸ | DHFR | P00374 | 3/20 | 0.56 |
| ▸ | TYMS | P04818 | 3/20 | 0.56 |
| ▸ | FOLR2 | P14207 | 6/20 | 0.55 |
| ▸ | ATIC | P31939 | 6/20 | 0.55 |
| ▸ | SHMT1 | P34896 | 4/20 | 0.51 |
| ▸ | SHMT2 | P34897 | 3/20 | 0.51 |
| ▸ | FRK | P42685 | 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 | |
|---|---|---|---|---|
| SCHEMBL9439839 | 0.95 | FOLR1 (0.74) | FOLR1SLC46A1SLC19A1GARTDHFR | |
| SCHEMBL9439728 | 0.92 | FOLR1 (0.76) | FOLR1SLC46A1SLC19A1GARTDHFR | |
| SCHEMBL9225829 | 0.92 | FOLR1 (0.70) | FOLR1SLC46A1SLC19A1GARTDHFR | |
| SCHEMBL9224206 | 0.92 | FOLR1 (0.70) | FOLR1SLC46A1SLC19A1GARTDHFR | |
| SCHEMBL9439758 | 0.90 | FOLR1 (0.76) | FOLR1SLC46A1SLC19A1GARTDHFR | |
| SCHEMBL9564163 | 0.90 | FOLR1 (0.62) | FOLR1SLC46A1SLC19A1GARTDHFR | |
| SCHEMBL9221180 | 0.89 | FOLR1 (0.71) | FOLR1SLC46A1SLC19A1GARTDHFR | |
| SCHEMBL9439922 | 0.87 | FOLR1 (0.57) | FOLR1SLC46A1SLC19A1GARTDHFR | |
| SCHEMBL9439748 | 0.87 | FOLR1 (0.75) | FOLR1SLC46A1SLC19A1GARTDHFR | |
| SCHEMBL9439759 | 0.87 | FOLR1 (0.75) | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-3173890-A | — | — | None | — | — | JP | disclosed |
| US-5354754-A | Antitumor and -carcinogenic agents; treating human epidermoid carcinoma KB | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1994-10-11 | — | — | US | disclosed |
| JP-H03173890-A | PYRROLO(2,3-D)PYRIMIDINE DERIVATIVE, ITS PRODUCTION, USE AND INTERMEDIATE | TAKEDA CHEM IND LTD | 1991-07-29 | — | — | JP | disclosed |
| EP-0418924-A2 | Pyrrolopyrimidines, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1991-03-27 | — | — | EP | disclosed |