Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTHFD1 | P11586 | 1/20 | 0.59 |
| ▸ | SOST | Q9BQB4 | 1/20 | 0.55 |
| ▸ | ATIC | P31939 | 3/20 | 0.53 |
| ▸ | DHFR | P00374 | 2/20 | 0.52 |
| ▸ | GART | P22102 | 3/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL9220611 | 0.97 | MTHFD1 (0.56) | MTHFD1SOSTATICDHFRGART | |
| SCHEMBL9220625 | 0.90 | MTHFD1 (0.49) | MTHFD1SOSTATICDHFRGART | |
| SCHEMBL8997257 | 0.86 | GART (0.61) | ATICDHFRGART | |
| SCHEMBL8997170 | 0.85 | DHFR (0.55) | ATICDHFRGART | |
| SCHEMBL9042931 | 0.85 | DHFR (0.60) | ATICDHFRGART | |
| SCHEMBL9758306 | 0.85 | DHFR (0.55) | ATICDHFRGART | |
| SCHEMBL9043308 | 0.85 | DHFR (0.57) | ATICDHFRGART | |
| SCHEMBL9088274 | 0.85 | ATIC (0.51) | MTHFD1ATICDHFRGART | |
| SCHEMBL9041616 | 0.85 | GART (0.54) | MTHFD1ATICGART | |
| SCHEMBL8571393 | 0.84 | ATIC (0.59) | MTHFD1ATICDHFR |
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-0400562-B1 | Pyrrolopyrimidines, their production and use as tumoricidal agents | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1996-08-21 | — | — | EP | disclosed |