Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 16/20 | 0.60 |
| ▸ | CDK2 | P24941 | 15/20 | 0.60 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.60 |
| ▸ | CCNE1 | P24864 | 3/20 | 0.60 |
| ▸ | CA2 | P00918 | 4/20 | 0.59 |
| ▸ | KDR | P35968 | 13/20 | 0.44 |
| ▸ | CDK4 | P11802 | 2/20 | 0.43 |
| ▸ | CDK7 | P50613 | 2/20 | 0.43 |
| ▸ | CDK9 | P50750 | 2/20 | 0.43 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.43 |
| ▸ | CCND1 | P24385 | 1/20 | 0.43 |
| ▸ | CCNH | P51946 | 1/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.43 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | SYK | P43405 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13898381 | 0.88 | CDK1 (0.67) | CDK1CDK2CCNB1CCNE1CA2 | |
| SCHEMBL13898557 | 0.86 | CDK1 (0.60) | CDK1CDK2CCNB1CCNE1CA2 | |
| SCHEMBL3872095 | 0.85 | CDK2 (0.59) | CDK1CDK2CCNB1CCNE1CA2 | |
| SCHEMBL13897549 | 0.83 | CDK1 (0.70) | CDK1CDK2CCNB1CCNE1CA2 | |
| SCHEMBL13898570 | 0.82 | CDK2 (0.69) | CDK1CDK2CCNB1CCNE1CA2 | |
| SCHEMBL13897631 | 0.80 | CDK1 (0.65) | CDK1CDK2CCNB1CCNE1CA2 | |
| SCHEMBL3870543 | 0.80 | CDK1 (0.65) | CDK1CDK2CCNB1CCNE1CA2 | |
| SCHEMBL4025895 | 0.79 | CDK1 (0.70) | CDK1CDK2CCNB1CCNE1CA2 | |
| SCHEMBL4019758 | 0.79 | CDK1 (0.70) | CDK1CDK2CCNB1CCNE1CA2 | |
| SCHEMBL14498989 | 0.79 | CDK2 (0.64) | CDK1CDK2CCNB1CCNE1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7504410-B2 | Chk-, Pdk- and Akt-inhibitory pyrimidines, their production and use as pharmaceutical agents | SCHERING AKTIENGESELLSCHAFT (DE) | 2009-03-17 | — | — | US | disclosed |
| US-7504410-B2 | Chk-, Pdk- and Akt-inhibitory pyrimidines, their production and use as pharmaceutical agents | SCHERING AKTIENGESELLSCHAFT (DE) | 2009-03-17 | — | — | US | disclosed |