Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBK1 | Q9UHD2 | 4/20 | 0.45 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | SIRT5 | Q9NXA8 | 6/20 | 0.42 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.42 |
| ▸ | CDK2 | P24941 | 4/20 | 0.40 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.40 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.40 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.40 |
| ▸ | CCNT1 | O60563 | 3/20 | 0.40 |
| ▸ | CDK9 | P50750 | 3/20 | 0.40 |
| ▸ | CDK1 | P06493 | 2/20 | 0.40 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.40 |
| ▸ | CFTR | P13569 | 1/20 | 0.40 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.40 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.40 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.39 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.39 |
| ▸ | CDK4 | P11802 | 1/20 | 0.39 |
| ▸ | CCND1 | P24385 | 1/20 | 0.39 |
| ▸ | CDK7 | P50613 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3865006 | 0.87 | TBK1 (0.49) | TBK1SIRT5CDK2PDPK1 | |
| SCHEMBL3864671 | 0.87 | TBK1 (0.38) | TBK1BRD4SIRT5TLR8CDK2 | |
| SCHEMBL3864678 | 0.87 | TBK1 (0.38) | TBK1BRD4SIRT5TLR8CDK2 | |
| SCHEMBL3865668 | 0.86 | TLR8 (0.49) | TBK1BRD4SIRT5TLR8CDK2 | |
| SCHEMBL3865654 | 0.86 | TLR8 (0.49) | TBK1BRD4SIRT5TLR8CDK2 | |
| SCHEMBL3874672 | 0.84 | TBK1 (0.46) | TBK1SIRT5CDK2PDPK1STK17A | |
| SCHEMBL13897705 | 0.79 | SIRT5 (0.46) | TBK1SIRT5 | |
| SCHEMBL13897419 | 0.78 | TBK1 (0.45) | TBK1SIRT5TLR8CDK2CCNA2 | |
| SCHEMBL12106416 | 0.75 | PDPK1 (0.55) | TBK1SIRT5CDK2PDPK1STK17A | |
| SCHEMBL3871309 | 0.75 | TBK1 (0.38) | TBK1SIRT5CDK2PDPK1STK17A |
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-1565446-A1 | CHK-, PDK- AND AKT-INHIBITORY PYRIMIDINES, THEIR PRODUCTION AND USE AS PHARMACEUTICAL AGENTS | SCHERING AKTIENGESELLSCHAFT (DE) | 2005-08-24 | — | — | EP | disclosed |
| WO-2004048343-A1 | CHK-, PDK- AND AKT-INHIBITORY PYRIMIDINES, THEIR PRODUCTION AND USE AS PHARMACEUTICAL AGENTS | SCHERING AKTIENGESELLSCHAFT (DE) | 2004-06-10 | — | — | WO | disclosed |