Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 4/20 | 0.45 |
| ▸ | CDK2 | P24941 | 4/20 | 0.45 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 4/20 | 0.41 |
| ▸ | DRD3 | P35462 | 4/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.41 |
| ▸ | DRD4 | P21917 | 2/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13289231 | 0.95 | DRD2 (0.46) | GSK3BCDK2IDO1DRD2DRD3 | |
| SCHEMBL13120297 | 0.89 | CDK2 (0.58) | GSK3BCDK2IDO1DRD2DRD3 | |
| SCHEMBL13288754 | 0.89 | CDK2 (0.45) | GSK3BCDK2DRD2DRD3DRD4 | |
| SCHEMBL13288882 | 0.89 | CDK2 (0.54) | GSK3BCDK2DRD2DRD3HDAC3 | |
| SCHEMBL13289275 | 0.88 | HDAC1 (0.42) | GSK3BCDK2HDAC3HDAC1HDAC4 | |
| SCHEMBL14545832 | 0.87 | CDK2 (0.48) | GSK3BCDK2 | |
| SCHEMBL13288895 | 0.87 | GSK3B (0.43) | GSK3BCDK2CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL14545261 | 0.87 | CDK2 (0.53) | GSK3BCDK2CYP2C19 | |
| SCHEMBL14545971 | 0.87 | NPC1 (0.43) | GSK3BCDK2 | |
| SCHEMBL13289235 | 0.86 | CDK2 (0.45) | GSK3BCDK2DRD2DRD3DRD4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007044449-A2 | NOVEL PYRAZOLOPYRIMIDINES AS CYCLIN DEPENDENT KINASE INHIBITORS | SCHERING CORPORATION (US) | 2007-04-19 | — | — | WO | disclosed |