Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 7/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8444708 | 0.88 | DHFR (0.49) | DHFR | |
| SCHEMBL5189458 | 0.88 | DHFR (0.56) | DHFR | |
| SCHEMBL29430182 | 0.88 | DHFR (0.56) | DHFR | |
| SCHEMBL5189451 | 0.88 | DHFR (0.56) | DHFR | |
| Bromide SCHEMBL8420545 | 0.87 | DHFR (0.55) | DHFR | |
| SCHEMBL14987839 | 0.85 | DHFR (0.61) | DHFR | |
| SCHEMBL8051870 | 0.82 | DHFR (0.50) | DHFR | |
| SCHEMBL8444709 | 0.82 | DHFR (0.47) | DHFR | |
| SCHEMBL7253914 | 0.80 | DHFR (0.47) | DHFR | |
| SCHEMBL8446677 | 0.78 | HDAC4 (0.49) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0676399-B1 | METHOTREXATE DERIVATIVES | CHUGAI PHARMACEUTICAL CO LTD (JP) | 1999-09-15 | — | — | EP | disclosed |