Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.48 |
| ▸ | TBK1 | Q9UHD2 | 2/20 | 0.47 |
| ▸ | CDK1 | P06493 | 16/20 | 0.47 |
| ▸ | CDK2 | P24941 | 15/20 | 0.47 |
| ▸ | KDR | P35968 | 15/20 | 0.47 |
| ▸ | STK17B | O94768 | 1/20 | 0.46 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.46 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.44 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.44 |
| ▸ | CDK4 | P11802 | 2/20 | 0.44 |
| ▸ | CDK7 | P50613 | 2/20 | 0.44 |
| ▸ | CDK9 | P50750 | 2/20 | 0.44 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.44 |
| ▸ | CCND1 | P24385 | 1/20 | 0.44 |
| ▸ | CCNH | P51946 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4063585 | 0.83 | CA2 (0.61) | CA2TBK1CDK1CDK2KDR | |
| SCHEMBL4066912 | 0.83 | SYK (0.51) | CA2TBK1CDK1CDK2KDR | |
| SCHEMBL3865508 | 0.81 | CA2 (0.60) | CA2TBK1CDK1CDK2KDR | |
| SCHEMBL4065623 | 0.80 | CA2 (0.57) | CA2TBK1CDK1CDK2KDR | |
| SCHEMBL4068494 | 0.80 | CA2 (0.55) | CA2TBK1CDK1CDK2KDR | |
| SCHEMBL4061057 | 0.79 | CDK1 (0.55) | CA2CDK1CDK2KDRCCNB1 | |
| SCHEMBL6448921 | 0.77 | CA2 (0.65) | CA2TBK1CDK1CDK2KDR | |
| SCHEMBL4064363 | 0.76 | CDK1 (0.55) | CA2CDK1CDK2KDRCCNB1 | |
| SCHEMBL3874620 | 0.76 | CA2 (0.64) | CA2TBK1CDK1CDK2KDR | |
| SCHEMBL13648585 | 0.76 | CA2 (0.55) | CA2TBK1CDK1CDK2KDR |
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-1392662-B1 | CDK INHIBITING PYRIMIDINES, PRODUCTION THEREOF AND THEIR USE AS MEDICAMENTS | BAYER SCHERING PHARMA AG (DE) | 2009-01-07 | — | — | EP | claimed |
| EP-1392662-B1 | CDK INHIBITING PYRIMIDINES, PRODUCTION THEREOF AND THEIR USE AS MEDICAMENTS | BAYER SCHERING PHARMA AG (DE) | 2009-01-07 | — | — | EP | disclosed |