Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | RIPK1 | Q13546 | 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 | |
|---|---|---|---|---|
| SCHEMBL777108 | 0.77 | CES2 (0.35) | CES2BCHECES1 | |
| SCHEMBL6874177 | 0.77 | CES2 (0.35) | CES2BCHECES1 | |
| SCHEMBL777916 | 0.76 | CES2 (0.38) | CES2BCHECES1 | |
| SCHEMBL20877639 | 0.75 | GPR3 (0.40) | — | |
| SCHEMBL20877679 | 0.75 | GPR3 (0.40) | — | |
| SCHEMBL7217956 | 0.74 | CES2 (0.40) | CES2CES1 | |
| SCHEMBL23912724 | 0.72 | CES2 (0.35) | CES2BCHECES1 | |
| SCHEMBL20048699 | 0.72 | CES2 (0.35) | CES2BCHECES1 | |
| SCHEMBL775886 | 0.72 | CES2 (0.32) | BACE1CES2BCHECES1RIPK1 | |
| SCHEMBL777213 | 0.69 | CES2 (0.31) | CES2BCHECES1 |
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-2342200-B1 | Compounds which selectively modulate the cb2 receptor | BOEHRINGER INGELHEIM INT (DE) | 2013-01-23 | — | — | EP | disclosed |