Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 14/20 | 0.56 |
| ▸ | CCND1 | P24385 | 14/20 | 0.56 |
| ▸ | CDK11A | Q9UQ88 | 13/20 | 0.56 |
| ▸ | CCNT1 | O60563 | 12/20 | 0.56 |
| ▸ | CDK9 | P50750 | 12/20 | 0.56 |
| ▸ | CDK6 | Q00534 | 12/20 | 0.56 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.50 |
| ▸ | LTK | P29376 | 1/20 | 0.50 |
| ▸ | CLK2 | P49760 | 1/20 | 0.50 |
| ▸ | GSK3A | P49840 | 1/20 | 0.50 |
| ▸ | GSK3B | P49841 | 1/20 | 0.50 |
| ▸ | CDK7 | P50613 | 1/20 | 0.50 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.50 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.50 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.50 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.50 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.50 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.47 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.42 |
| ▸ | CCNA2 | P20248 | 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 | |
|---|---|---|---|---|
| SCHEMBL5743032 | 0.93 | CDK4 (0.61) | CDK4CCND1CDK11ACCNT1CDK9 | |
| SCHEMBL5859407 | 0.90 | CDK4 (0.61) | CDK4CCND1CDK11ACCNT1CDK9 | |
| SCHEMBL5742538 | 0.88 | CDK4 (0.58) | CDK4CCND1CDK11ACCNT1CDK9 | |
| SCHEMBL5743262 | 0.86 | CDK4 (0.56) | CDK4CCND1CDK11ACCNT1CDK9 | |
| SCHEMBL5743265 | 0.86 | CDK4 (0.56) | CDK4CCND1CDK11ACCNT1CDK9 | |
| SCHEMBL5743966 | 0.82 | CDK4 (0.66) | CDK4CCND1CDK11ACCNT1CDK9 | |
| SCHEMBL5743671 | 0.81 | CDK4 (0.64) | CDK4CCND1CDK11ACCNT1CDK9 | |
| SCHEMBL5742133 | 0.80 | CDK4 (0.67) | CDK4CCND1CDK11ACCNT1CDK9 | |
| SCHEMBL5743442 | 0.79 | CDK4 (0.55) | CDK4CCND1CDK11ACCNT1CDK9 | |
| SCHEMBL5742039 | 0.78 | CDK4 (0.61) | CDK4CCND1CDK11ACCNT1CDK9 |
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-1358169-A2 | DIAMINOTHIAZOLES AND THEIR USE AS INHIBITORS OF CYCLIN-DEPENDENT KINASE | F. HOFFMANN-LA ROCHE AG (CH) | 2003-11-05 | — | — | EP | disclosed |
| WO-2002057261-A2 | DIAMINOTHIAZOLES AND THEIR USE AS INHIBITORS OF CYCLIN-DEPENDENT KINASE | F. HOFFMANN-LA ROCHE AG (CH) | 2002-07-25 | — | — | WO | disclosed |