Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK6 | Q16659 | 12/20 | 0.57 |
| ▸ | GSK3A | P49840 | 2/20 | 0.47 |
| ▸ | GSK3B | P49841 | 2/20 | 0.47 |
| ▸ | EIF2AK4 | Q9P2K8 | 2/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.40 |
| ▸ | SMURF1 | Q9HCE7 | 1/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16014961 | 0.86 | MAPK6 (0.72) | MAPK6GSK3AGSK3BEIF2AK4PDE4B | |
| SCHEMBL18830261 | 0.85 | MAPK6 (0.56) | MAPK6GSK3AGSK3BEIF2AK4 | |
| SCHEMBL18830624 | 0.83 | MAPK6 (0.50) | MAPK6GSK3AGSK3BEIF2AK4AURKA | |
| Carbamic Acid SCHEMBL18813057 | 0.82 | MAPK6 (0.64) | MAPK6GSK3AGSK3BEIF2AK4PDE4B | |
| SCHEMBL18830192 | 0.81 | MAPK6 (0.55) | MAPK6GSK3AGSK3BAURKA | |
| SCHEMBL18830615 | 0.81 | MAPK6 (0.55) | MAPK6GSK3AGSK3BAURKA | |
| SCHEMBL16022138 | 0.81 | MAPK6 (0.55) | MAPK6GSK3AGSK3BAURKA | |
| SCHEMBL18830606 | 0.80 | MAPK6 (0.75) | MAPK6GSK3AGSK3BEIF2AK4AURKA | |
| SCHEMBL16022218 | 0.77 | MAPK6 (0.71) | MAPK6GSK3AGSK3BEIF2AK4PDE4B | |
| SCHEMBL18830347 | 0.76 | MAPK6 (0.45) | MAPK6GSK3AGSK3BEIF2AK4 |
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-2964649-B1 | TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF DISEASES SUCH AS CANCER | MERCK PATENT GMBH (DE) | 2017-05-10 | — | — | EP | disclosed |