Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK6 | Q16659 | 13/20 | 1.00 |
| ▸ | GSK3A | P49840 | 1/20 | 0.60 |
| ▸ | GSK3B | P49841 | 1/20 | 0.60 |
| ▸ | EIF2AK4 | Q9P2K8 | 2/20 | 0.56 |
| ▸ | CDK7 | P50613 | 1/20 | 0.46 |
| ▸ | CDK9 | P50750 | 1/20 | 0.46 |
| ▸ | MAPK8 | P45983 | 3/20 | 0.46 |
| ▸ | MAPK10 | P53779 | 3/20 | 0.46 |
| ▸ | MAPK9 | P45984 | 2/20 | 0.46 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.46 |
| ▸ | CDK2 | P24941 | 1/20 | 0.46 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL16011970 | 1.00 | MAPK6 (1.00) | MAPK6GSK3AGSK3BEIF2AK4CDK7 | |
| SCHEMBL16011969 | 1.00 | MAPK6 (1.00) | MAPK6GSK3AGSK3BEIF2AK4CDK7 | |
| SCHEMBL16012025 | 1.00 | MAPK6 (1.00) | MAPK6GSK3AGSK3BEIF2AK4CDK7 | |
| SCHEMBL16012215 | 0.95 | MAPK6 (0.90) | MAPK6GSK3AGSK3BEIF2AK4 | |
| SCHEMBL16012287 | 0.94 | MAPK6 (1.00) | MAPK6GSK3AGSK3BEIF2AK4 | |
| SCHEMBL16012108 | 0.94 | MAPK6 (1.00) | MAPK6GSK3AGSK3BEIF2AK4 | |
| SCHEMBL16012110 | 0.94 | MAPK6 (1.00) | MAPK6GSK3AGSK3BEIF2AK4 | |
| SCHEMBL16012286 | 0.94 | MAPK6 (1.00) | MAPK6GSK3AGSK3BEIF2AK4 | |
| SCHEMBL16012109 | 0.94 | MAPK6 (1.00) | MAPK6GSK3AGSK3BEIF2AK4 | |
| Hydrochloric Acid SCHEMBL16011966 | 0.93 | MAPK6 (0.98) | 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 |