Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 13/20 | 0.60 |
| ▸ | TYMS | P04818 | 4/20 | 0.54 |
| ▸ | GART | P22102 | 2/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL9844787 | 0.95 | DHFR (0.61) | DHFRTYMSGART | |
| SCHEMBL9844911 | 0.84 | DHFR (0.56) | DHFRTYMS | |
| SCHEMBL9844878 | 0.82 | GART (0.72) | DHFRTYMSGART | |
| SCHEMBL9844849 | 0.81 | GART (0.67) | DHFRTYMSGART | |
| SCHEMBL9535831 | 0.81 | GART (0.72) | DHFRTYMSGART | |
| SCHEMBL10405409 | 0.80 | DHFR (0.63) | DHFRGART | |
| SCHEMBL9844785 | 0.79 | DHFR (0.55) | DHFRTYMSGART | |
| SCHEMBL9220727 | 0.79 | DHFR (0.79) | DHFRTYMSGART | |
| SCHEMBL9339136 | 0.79 | GART (0.68) | DHFRTYMSGART | |
| SCHEMBL9844791 | 0.79 | GART (0.73) | DHFRGART |
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 1 patent. 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 | disclosed |