Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 13/20 | 0.54 |
| ▸ | CDK1 | P06493 | 10/20 | 0.54 |
| ▸ | CDK2 | P24941 | 10/20 | 0.54 |
| ▸ | CA2 | P00918 | 3/20 | 0.54 |
| ▸ | CDK4 | P11802 | 3/20 | 0.54 |
| ▸ | CDK7 | P50613 | 3/20 | 0.54 |
| ▸ | CDK9 | P50750 | 3/20 | 0.54 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.54 |
| ▸ | CCND1 | P24385 | 1/20 | 0.54 |
| ▸ | CCNH | P51946 | 1/20 | 0.54 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.54 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.54 |
| ▸ | SRC | P12931 | 5/20 | 0.44 |
| ▸ | BRD4 | O60885 | 4/20 | 0.43 |
| ▸ | ABL1 | P00519 | 2/20 | 0.43 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.43 |
| ▸ | PLK4 | O00444 | 1/20 | 0.43 |
| ▸ | STK25 | O00506 | 1/20 | 0.43 |
| ▸ | CIT | O14578 | 1/20 | 0.43 |
| ▸ | RIOK3 | O14730 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4065978 | 1.00 | KDR (0.54) | KDRCDK1CDK2CA2CDK4 | |
| SCHEMBL4062490 | 0.99 | KDR (0.54) | KDRCDK1CDK2CA2CDK4 | |
| SCHEMBL4062724 | 0.93 | KDR (0.52) | KDRCDK1CDK2CA2CDK4 | |
| SCHEMBL4064797 | 0.91 | BRD4 (0.44) | KDRCDK1CDK2CA2CDK4 | |
| SCHEMBL4066724 | 0.90 | BRD4 (0.44) | KDRCDK1CDK2CA2CDK4 | |
| SCHEMBL4065573 | 0.88 | CDK1 (0.66) | KDRCDK1CDK2CA2CDK4 | |
| SCHEMBL4060897 | 0.87 | CDK1 (0.65) | KDRCDK1CDK2CA2CDK4 | |
| SCHEMBL4066641 | 0.87 | KDR (0.60) | KDRCDK1CDK2CA2CDK4 | |
| SCHEMBL4060664 | 0.86 | KDR (0.50) | KDRCDK1CDK2CA2CDK4 | |
| SCHEMBL4061605 | 0.86 | KDR (0.50) | KDRCDK1CDK2CA2CDK4 |
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-1392662-B1 | CDK INHIBITING PYRIMIDINES, PRODUCTION THEREOF AND THEIR USE AS MEDICAMENTS | BAYER SCHERING PHARMA AG (DE) | 2009-01-07 | — | — | EP | disclosed |