Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GART | P22102 | 3/20 | 0.48 |
| ▸ | ATIC | P31939 | 2/20 | 0.44 |
| ▸ | DHFR | P00374 | 3/20 | 0.43 |
| ▸ | FOLR1 | P15328 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9439711 | 0.90 | GART (0.49) | GARTATICDHFRFOLR1 | |
| SCHEMBL8997253 | 0.85 | DHFR (0.58) | GARTATICDHFR | |
| SCHEMBL9439574 | 0.85 | GART (0.62) | GARTATICDHFRFOLR1 | |
| SCHEMBL9439570 | 0.84 | GART (0.58) | GARTATICDHFRFOLR1 | |
| SCHEMBL9041616 | 0.83 | GART (0.54) | GARTATICFOLR1 | |
| SCHEMBL9042993 | 0.82 | GART (0.48) | GARTATICDHFRFOLR1 | |
| SCHEMBL9439622 | 0.82 | GART (0.48) | GARTATICDHFRFOLR1 | |
| SCHEMBL9397716 | 0.82 | DHFR (0.53) | GARTATICDHFR | |
| SCHEMBL8997170 | 0.79 | DHFR (0.55) | GARTATICDHFR | |
| SCHEMBL9758306 | 0.79 | DHFR (0.55) | GARTATICDHFR |
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 |