Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 17/20 | 0.63 |
| ▸ | CDK1 | P06493 | 16/20 | 0.63 |
| ▸ | KDR | P35968 | 11/20 | 0.63 |
| ▸ | CA2 | P00918 | 4/20 | 0.63 |
| ▸ | CDK4 | P11802 | 2/20 | 0.63 |
| ▸ | CDK7 | P50613 | 2/20 | 0.63 |
| ▸ | CDK9 | P50750 | 2/20 | 0.63 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.63 |
| ▸ | CCND1 | P24385 | 1/20 | 0.63 |
| ▸ | CCNH | P51946 | 1/20 | 0.63 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.62 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.62 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | CLK1 | P49759 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.47 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL4020087 | 1.00 | CDK2 (0.63) | CDK2CDK1KDRCA2CDK4 | |
| SCHEMBL3931675 | 0.90 | CDK1 (0.56) | CDK2CDK1KDRCA2CDK4 | |
| SCHEMBL13648442 | 0.88 | CDK2 (0.64) | CDK2CDK1KDRCA2CDK4 | |
| SCHEMBL4057630 | 0.88 | CDK1 (0.80) | CDK2CDK1KDRCA2CDK4 | |
| SCHEMBL4063258 | 0.88 | CDK1 (0.80) | CDK2CDK1KDRCA2CDK4 | |
| SCHEMBL5175505 | 0.88 | CDK2 (0.63) | CDK2CDK1KDRCA2CDK4 | |
| SCHEMBL4017020 | 0.88 | CDK2 (0.63) | CDK2CDK1KDRCA2CDK4 | |
| SCHEMBL13648651 | 0.88 | CDK2 (0.63) | CDK2CDK1KDRCA2CDK4 | |
| SCHEMBL4579849 | 0.84 | CDK1 (0.44) | CDK2CDK1KDRCA2CDK4 | |
| SCHEMBL4020090 | 0.83 | CDK1 (0.58) | CDK2CDK1KDRCA2CDK4 |
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 |
|---|---|---|---|---|---|---|---|
| US-7291624-B2 | CDK-inhibitory pyrimidines, their production and use as pharmaceutical agents | BAYER SCHERING PHARMA AG (DE) | 2007-11-06 | — | — | US | disclosed |