Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 7/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8445277 | 0.94 | DHFR (0.51) | DHFR | |
| SCHEMBL7162992 | 0.92 | DHFR (0.58) | DHFR | |
| SCHEMBL7164303 | 0.92 | DHFR (0.64) | DHFR | |
| SCHEMBL8444709 | 0.88 | DHFR (0.47) | DHFR | |
| SCHEMBL8446723 | 0.88 | DHFR (0.62) | DHFR | |
| SCHEMBL8446969 | 0.88 | DHFR (0.53) | DHFR | |
| SCHEMBL8521499 | 0.87 | DHFR (0.54) | DHFR | |
| SCHEMBL8521494 | 0.87 | DHFR (0.54) | DHFR | |
| Ammonia Solution, Strong SCHEMBL27292117 | 0.86 | DHFR (0.54) | DHFR | |
| SCHEMBL8447876 | 0.86 | DHFR (0.56) | DHFR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0543997-B1 | DERIVATIVES OF METHOTREXATE WITH ANTIRHEUMATIC ACTIVITY | CHUGAI PHARMACEUTICAL CO LTD (JP) | 1999-12-08 | — | — | EP | disclosed |
| US-5354753-A | Methotrexate derivative | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 1994-10-11 | — | — | US | disclosed |
| EP-0543997-A1 | NOVEL METHOTREXATE DERIVATIVE | Chugai Seiyaku Kabushiki Kaisha (JP) | 1993-06-02 | — | — | EP | disclosed |