Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 13/20 | 0.52 |
| ▸ | TYMS | P04818 | 6/20 | 0.52 |
| ▸ | GART | P22102 | 2/20 | 0.47 |
| ▸ | ATIC | P31939 | 2/20 | 0.47 |
| ▸ | FOLR2 | P14207 | 1/20 | 0.47 |
| ▸ | FOLR1 | P15328 | 1/20 | 0.47 |
| ▸ | SHMT1 | P34896 | 1/20 | 0.47 |
| ▸ | SLC19A1 | P41440 | 1/20 | 0.47 |
| ▸ | FRK | P42685 | 1/20 | 0.47 |
| ▸ | SLC46A1 | Q96NT5 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9844856 | 0.86 | DHFR (0.43) | DHFRTYMS | |
| SCHEMBL9844852 | 0.86 | DHFR (0.43) | DHFRTYMS | |
| Butane SCHEMBL9844926 | 0.86 | DHFR (0.40) | DHFRTYMSGARTATICFOLR2 | |
| SCHEMBL9844793 | 0.84 | DHFR (0.55) | DHFRTYMSGARTATICFOLR2 | |
| SCHEMBL9844802 | 0.84 | AGTR1 (0.40) | — | |
| Butane SCHEMBL9844893 | 0.81 | DHFR (0.55) | DHFRTYMSGARTATICFOLR2 | |
| SCHEMBL9556787 | 0.81 | DRD2 (0.45) | — | |
| SCHEMBL9844820 | 0.78 | DHFR (0.61) | DHFRTYMSGARTATICFOLR2 | |
| SCHEMBL9844817 | 0.78 | DHFR (0.61) | DHFRTYMSGARTATICFOLR2 | |
| SCHEMBL9339136 | 0.77 | GART (0.68) | DHFRTYMSGARTATICFOLR2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0438261-A2 | Condensed heterocyclic glutamic acid derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1991-07-24 | — | — | EP | claimed |
| EP-0438261-A2 | Condensed heterocyclic glutamic acid derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1991-07-24 | — | — | EP | disclosed |