Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | VCP | P55072 | 1/20 | 0.31 |
| ▸ | HRH4 | Q9H3N8 | 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 | |
|---|---|---|---|---|
| SCHEMBL20209580 | 0.84 | MAP4K1 (0.35) | MAP4K1ADORA2AADORA1 | |
| SCHEMBL21486348 | 0.84 | MAP4K1 (0.42) | MAP4K1ADORA2AADORA1VCP | |
| SCHEMBL29624927 | 0.79 | MAP4K1 (0.41) | MAP4K1ADORA2AADORA1VCP | |
| SCHEMBL21482756 | 0.79 | MAP4K1 (0.41) | MAP4K1ADORA2AADORA1VCP | |
| SCHEMBL17090692 | 0.72 | ADORA2A (0.38) | MAP4K1ADORA2AADORA1HRH4 | |
| SCHEMBL13072745 | 0.70 | ADORA2A (0.37) | MAP4K1ADORA2AADORA1HRH4 | |
| SCHEMBL20209150 | 0.70 | MAPK1 (0.40) | — | |
| SCHEMBL5925821 | 0.67 | ADORA2A (0.35) | MAP4K1ADORA2AADORA1HRH4 | |
| SCHEMBL2377758 | 0.60 | ABL1 (0.59) | MAP4K1ADORA2AADORA1 | |
| SCHEMBL31526668 | 0.60 | CDK5 (0.44) | MAP4K1ADORA2AADORA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018096325-A1 | BENZODIAZOLIUM COMPOUNDS AS ENAC INHIBITORS | Enterprise Therapeutics Limited (GB) | 2018-05-31 | — | — | WO | disclosed |