Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18871859 | 1.00 | GSK3B (0.40) | GSK3BADORA3ADORA2AADORA1NOS2 | |
| SCHEMBL20651273 | 0.78 | GSK3B (0.33) | GSK3B | |
| SCHEMBL12324881 | 0.77 | GSK3B (0.35) | GSK3B | |
| SCHEMBL29995515 | 0.74 | GSK3B (0.31) | GSK3B | |
| SCHEMBL28207488 | 0.74 | GSK3B (0.34) | GSK3B | |
| SCHEMBL4576815 | 0.73 | NAPRT (0.34) | GSK3B | |
| SCHEMBL15973037 | 0.73 | GSK3B (0.30) | GSK3B | |
| SCHEMBL19724630 | 0.71 | — | — | |
| SCHEMBL19142929 | 0.70 | GSK3B (0.40) | GSK3B | |
| SCHEMBL12159337 | 0.68 | GAA (0.44) | NOS2 |
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-2922840-B1 | BICYCLIC HETEROCYCLE SUBSTITUTED PYRIDYL COMPOUNDS USEFUL AS KINASE MODULATORS | BRISTOL MYERS SQUIBB CO (US) | 2016-12-21 | — | — | EP | disclosed |