Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 9/20 | 0.63 |
| ▸ | GART | P22102 | 6/20 | 0.59 |
| ▸ | FOLR2 | P14207 | 2/20 | 0.59 |
| ▸ | FOLR1 | P15328 | 2/20 | 0.59 |
| ▸ | SLC46A1 | Q96NT5 | 2/20 | 0.59 |
| ▸ | SLC19A1 | P41440 | 1/20 | 0.59 |
| ▸ | ATIC | P31939 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL9446115 | 0.91 | DHFR (0.75) | DHFRGARTFOLR2FOLR1SLC46A1 | |
| SCHEMBL9263780 | 0.87 | GART (0.67) | DHFRGARTFOLR2FOLR1SLC46A1 | |
| SCHEMBL24629143 | 0.87 | DHFR (0.55) | DHFRGART | |
| SCHEMBL25904683 | 0.86 | DHFR (0.54) | DHFRGART | |
| SCHEMBL12717668 | 0.86 | DHFR (0.72) | DHFR | |
| SCHEMBL12717676 | 0.86 | DHFR (0.72) | DHFR | |
| SCHEMBL9339136 | 0.85 | GART (0.68) | DHFRGARTFOLR2FOLR1SLC46A1 | |
| SCHEMBL9844787 | 0.84 | DHFR (0.61) | DHFRGARTFOLR2FOLR1SLC46A1 | |
| SCHEMBL6337570 | 0.84 | DHFR (0.77) | DHFRGARTFOLR2FOLR1SLC46A1 | |
| SCHEMBL9844791 | 0.84 | GART (0.73) | DHFRGARTFOLR2FOLR1SLC46A1 |
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-4946846-A | ANTITUMOR AGENTS; NONTOXIC | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1990-08-07 | — | — | US | claimed |
| US-4946846-A | ANTITUMOR AGENTS; NONTOXIC | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1990-08-07 | — | — | US | disclosed |