Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 6/20 | 0.70 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.46 |
| ▸ | SRC | P12931 | 1/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1388590 | 0.83 | DHFR (0.70) | DHFRFGFR1SRCADORA1ADORA2A | |
| SCHEMBL1388267 | 0.82 | DHFR (1.00) | DHFRFGFR1SRCADORA1ADORA2A | |
| SCHEMBL27419143 | 0.79 | DHFR (0.65) | DHFRFGFR1SRCADORA1ADORA2A | |
| SCHEMBL7279386 | 0.79 | DHFR (0.53) | DHFRFGFR1SRCADORA1 | |
| SCHEMBL27612523 | 0.79 | DHFR (0.64) | DHFRFGFR1SRCADORA1ADORA2A | |
| SCHEMBL1388760 | 0.78 | DHFR (0.74) | DHFRFGFR1SRCADORA1ADORA2A | |
| SCHEMBL1388517 | 0.78 | DHFR (0.74) | DHFRFGFR1SRCADORA1ADORA2A | |
| SCHEMBL1388741 | 0.77 | DHFR (0.79) | DHFRFGFR1SRCADORA1ADORA2A | |
| SCHEMBL4613214 | 0.76 | DHFR (0.53) | DHFRFGFR1SRCADORA1 | |
| SCHEMBL1388506 | 0.76 | DHFR (0.67) | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0679645-A1 | Pharmacologically active CNS pyridmidin compounds | THE WELLCOME FOUNDATION LIMITED (GB) | 1995-11-02 | — | — | EP | claimed |
| EP-0459819-A2 | Pharmacologically active CNS compound | THE WELLCOME FOUNDATION LIMITED (GB) | 1991-12-04 | — | — | EP | claimed |
| EP-0679645-A1 | Pharmacologically active CNS pyridmidin compounds | THE WELLCOME FOUNDATION LIMITED (GB) | 1995-11-02 | — | — | EP | disclosed |
| EP-0459819-A2 | Pharmacologically active CNS compound | THE WELLCOME FOUNDATION LIMITED (GB) | 1991-12-04 | — | — | EP | disclosed |