Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 7/20 | 0.72 |
| ▸ | CHEK1 | O14757 | 9/20 | 0.67 |
| ▸ | CDK1 | P06493 | 1/20 | 0.67 |
| ▸ | CDK2 | P24941 | 1/20 | 0.67 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL29819445 | 0.84 | KDR (1.00) | KDRCHEK1CDK1CDK2PDGFRB | |
| SCHEMBL6968182 | 0.84 | KDR (1.00) | KDRCHEK1CDK1CDK2PDGFRB | |
| SCHEMBL6958584 | 0.82 | KDR (0.78) | KDRCHEK1CDK1CDK2PDGFRB | |
| SCHEMBL7089495 | 0.82 | KDR (0.78) | KDRCHEK1CDK1CDK2PDGFRB | |
| SCHEMBL11865835 | 0.82 | KDR (0.78) | KDRCHEK1CDK1CDK2PDGFRB | |
| SCHEMBL6967709 | 0.82 | KDR (0.78) | KDRCHEK1CDK1CDK2PDGFRB | |
| SCHEMBL7002715 | 0.82 | KDR (0.78) | KDRCHEK1CDK1CDK2PDGFRB | |
| SCHEMBL7701869 | 0.82 | KDR (0.78) | KDRCHEK1CDK1CDK2PDGFRB | |
| SCHEMBL7000053 | 0.82 | CHEK1 (0.97) | KDRCHEK1CDK1CDK2 | |
| SCHEMBL7096380 | 0.81 | CHEK1 (0.94) | KDRCHEK1CDK1CDK2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1268437-A1 | INHIBITORS OF PROTEIN KINASES | Knoll GmbH (DE) | 2003-01-02 | — | — | EP | disclosed |
| WO-2002030908-A1 | INHIBITORS OF PROTEIN KINASES | KNOLL GMBH (DE) | 2002-04-18 | — | — | WO | disclosed |