Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 4/20 | 0.43 |
| ▸ | GSK3B | P49841 | 5/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CLK1 | P49759 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | PTGES | O14684 | 1/20 | 0.35 |
| ▸ | CCR1 | P32246 | 1/20 | 0.35 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 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 | |
|---|---|---|---|---|
| SCHEMBL13288926 | 0.95 | CDK2 (0.42) | CDK2GSK3BHTTSMN1; SMN2GFER | |
| SCHEMBL13121293 | 0.90 | CDK2 (0.55) | CDK2GSK3BGFER | |
| SCHEMBL14546009 | 0.90 | CDK2 (0.46) | CDK2GSK3BSMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL13289547 | 0.89 | CDK2 (0.46) | CDK2GSK3BSMN1; SMN2CCR1 | |
| SCHEMBL12954317 | 0.87 | GSK3B (0.45) | CDK2GSK3BMAPTALDH1A1LMNA | |
| SCHEMBL13289569 | 0.87 | CDK2 (0.51) | CDK2GSK3B | |
| SCHEMBL13289063 | 0.87 | GSK3B (0.45) | CDK2GSK3BHTTCCR1ALDH1A1 | |
| SCHEMBL13289128 | 0.85 | CDK2 (0.44) | CDK2GSK3BMAPTCCR1ALDH1A1 | |
| SCHEMBL13288981 | 0.85 | CDK2 (0.46) | CDK2GSK3BSMN1; SMN2GFERMAPT | |
| SCHEMBL13289301 | 0.85 | CDK2 (0.46) | CDK2GSK3BGFERMAPTNPSR1 |
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-2194058-A1 | Pyrazolopyrimidines suitable for the treatment of cancer diseases | SCHERING CORPORATION (US) | 2010-06-09 | — | — | EP | disclosed |