Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 13/20 | 1.00 |
| ▸ | CCNB1 | P14635 | 8/20 | 1.00 |
| ▸ | CCNB2 | O95067 | 5/20 | 1.00 |
| ▸ | CCNB3 | Q8WWL7 | 5/20 | 1.00 |
| ▸ | CDK2 | P24941 | 9/20 | 0.84 |
| ▸ | CCNE1 | P24864 | 8/20 | 0.84 |
| ▸ | CCNK | O75909 | 8/20 | 0.84 |
| ▸ | CDK12 | Q9NYV4 | 8/20 | 0.84 |
| ▸ | CDK5 | Q00535 | 8/20 | 0.84 |
| ▸ | CDK7 | P50613 | 6/20 | 0.84 |
| ▸ | CDK9 | P50750 | 6/20 | 0.84 |
| ▸ | CDK4 | P11802 | 4/20 | 0.84 |
| ▸ | CCND1 | P24385 | 4/20 | 0.84 |
| ▸ | CCNH | P51946 | 4/20 | 0.84 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.84 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.84 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.84 |
| ▸ | CCNT1 | O60563 | 3/20 | 0.84 |
| ▸ | CDK5R1 | Q15078 | 3/20 | 0.84 |
| ▸ | CSNK1D | P48730 | 2/20 | 0.84 |
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 | |
|---|---|---|---|---|
| (Rs)-Roscovitine SCHEMBL172593 | 0.91 | CDK1 (1.00) | CDK1CCNB1CCNB2CCNB3CDK2 | |
| Seliciclib SCHEMBL94728 | 0.91 | CDK1 (1.00) | CDK1CCNB1CCNB2CCNB3CDK2 | |
| (Rs)-Roscovitine SCHEMBL15163619 | 0.91 | CDK1 (1.00) | CDK1CCNB1CCNB2CCNB3CDK2 | |
| (S)-Roscovitine SCHEMBL2907488 | 0.91 | CDK1 (1.00) | CDK1CCNB1CCNB2CCNB3CDK2 | |
| (S)-Roscovitine SCHEMBL29415376 | 0.91 | CDK1 (1.00) | CDK1CCNB1CCNB2CCNB3CDK2 | |
| SCHEMBL4501614 | 0.90 | CDK2 (1.00) | CDK1CCNB1CCNB2CCNB3CDK2 | |
| SCHEMBL3877470 | 0.90 | CDK2 (1.00) | CDK1CCNB1CCNB2CCNB3CDK2 | |
| SCHEMBL2907920 | 0.90 | CDK1 (0.81) | CDK1CCNB1CCNB2CCNB3CDK2 | |
| SCHEMBL17628573 | 0.90 | CDK2 (1.00) | CDK1CCNB1CCNB2CCNB3CDK2 | |
| SCHEMBL1443401 | 0.90 | CDK1 (0.85) | CDK1CCNB1CCNB2CCNB3CDK2 |
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-1244668-B1 | PURINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND USE THEREOF | UNIVERSITAIRE INSTELLING ANTWE (BE) | 2006-04-05 | — | — | EP | disclosed |