Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.35 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL21512229 | 0.80 | ALDH1A1 (0.31) | L3MBTL1 | |
| SCHEMBL3401142 | 0.76 | TP53 (0.41) | TP53L3MBTL1ADORA1ADORA3ADORA2A | |
| SCHEMBL811725 | 0.76 | TP53 (0.41) | TP53L3MBTL1ADORA1ADORA3ADORA2A | |
| SCHEMBL15758528 | 0.75 | ALDH1A1 (0.39) | TP53L3MBTL1ADORA1ADORA3ADORA2A | |
| SCHEMBL15758529 | 0.75 | ALDH1A1 (0.39) | TP53L3MBTL1ADORA1ADORA3ADORA2A | |
| SCHEMBL15758898 | 0.72 | KDM4E (0.46) | HTT | |
| SCHEMBL2020536 | 0.68 | — | — | |
| SCHEMBL6855320 | 0.66 | ADORA1 (0.43) | TP53L3MBTL1ADORA1ADORA3ADORA2A | |
| SCHEMBL2020534 | 0.66 | — | — | |
| SCHEMBL11919151 | 0.66 | ADORA3 (0.32) | ADORA1ADORA3ADORA2A |
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-2881394-B1 | CONDENSED RING HETEROCYCLIC COMPOUND | KYOWA HAKKO KIRIN CO LTD (JP) | 2018-03-21 | — | — | EP | disclosed |