Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.32 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL314779 | 1.00 | ADORA2A (0.32) | ADORA2AADORA2BCYP3A4CYP2C19ADORA3 | |
| SCHEMBL314512 | 0.91 | WNT3A (0.34) | — | |
| SCHEMBL314511 | 0.91 | WNT3A (0.34) | — | |
| SCHEMBL2139978 | 0.91 | DHODH (0.35) | — | |
| SCHEMBL2139974 | 0.91 | DHODH (0.35) | — | |
| SCHEMBL314613 | 0.91 | WNT3A (0.34) | — | |
| SCHEMBL314614 | 0.91 | WNT3A (0.34) | — | |
| SCHEMBL314966 | 0.90 | — | — | |
| SCHEMBL3395742 | 0.90 | — | — | |
| SCHEMBL315036 | 0.90 | CYP2C19 (0.35) | ADORA2BCYP3A4CYP2C19 |
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-2066683-B1 | DERIVATIVES OF 5-THIOXYLOPYRANOSE AND USE OF SAME FOR TREATMENT | FOURNIER LAB SA (FR) | 2010-11-03 | — | — | EP | disclosed |