Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 4/20 | 0.51 |
| ▸ | FYN | P06241 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | USP7 | Q93009 | 2/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.38 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.38 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.38 |
| ▸ | AKT1 | P31749 | 1/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | MET | P08581 | 1/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 4/20 | 0.37 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.36 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.36 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29951522 | 0.85 | MAP4K4 (0.51) | CHEK2FYNUSP7MAP4K4MKNK1 | |
| SCHEMBL29952012 | 0.83 | CHEK2 (0.54) | CHEK2FYNMAP4K4CYP2A6CYP1A2 | |
| SCHEMBL2561948 | 0.82 | MAP4K4 (0.54) | CHEK2FYNUSP7MAP4K4CYP1A2 | |
| SCHEMBL2557950 | 0.81 | MAP4K4 (0.56) | CHEK2MAPK1USP7PIK3CAMAP4K4 | |
| SCHEMBL2558901 | 0.75 | CHEK2 (0.53) | CHEK2FYNUSP7MAP4K4MKNK1 | |
| SCHEMBL2554311 | 0.75 | MAP4K4 (0.43) | CHEK2FYNMAP4K4KCNH2MINK1 | |
| SCHEMBL29582823 | 0.74 | FYN (0.53) | CHEK2FYNMAPK1USP7AKT1 | |
| SCHEMBL26916746 | 0.74 | FYN (0.53) | CHEK2FYNMAPK1USP7AKT1 | |
| SCHEMBL2559978 | 0.72 | ADORA2A (0.49) | PIK3CDPIK3CGPIK3CAMAP4K4ADORA2A | |
| SCHEMBL29951470 | 0.71 | PIK3CA (0.33) | PIK3CAMAP4K4 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |