Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 8/20 | 0.51 |
| ▸ | CCND1 | P24385 | 8/20 | 0.51 |
| ▸ | CCNT1 | O60563 | 6/20 | 0.46 |
| ▸ | CDK9 | P50750 | 6/20 | 0.46 |
| ▸ | CDK6 | Q00534 | 6/20 | 0.46 |
| ▸ | CDK11A | Q9UQ88 | 5/20 | 0.46 |
| ▸ | ESRRG | P62508 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | LTK | P29376 | 1/20 | 0.39 |
| ▸ | CLK2 | P49760 | 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 | |
|---|---|---|---|---|
| SCHEMBL5743010 | 0.85 | CDK4 (0.70) | CDK4CCND1CCNT1CDK9CDK6 | |
| SCHEMBL5742997 | 0.75 | CDK4 (0.72) | CDK4CCND1CCNT1CDK9CDK6 | |
| SCHEMBL5741691 | 0.75 | CDK4 (0.71) | CDK4CCND1CCNT1CDK9CDK6 | |
| SCHEMBL5744236 | 0.73 | CDK4 (0.66) | CDK4CCND1CCNT1CDK9CDK6 | |
| SCHEMBL5741662 | 0.72 | CDK4 (0.72) | CDK4CCND1CCNT1CDK9CDK6 | |
| SCHEMBL5743774 | 0.70 | CDK4 (0.72) | CDK4CCND1CCNT1CDK9CDK6 | |
| SCHEMBL5742969 | 0.70 | CDK4 (0.71) | CDK4CCND1CCNT1CDK9CDK6 | |
| SCHEMBL5743054 | 0.70 | CDK4 (0.85) | CDK4CCND1CCNT1CDK9CDK6 | |
| SCHEMBL5861548 | 0.69 | CDK4 (0.68) | CDK4CCND1CCNT1CDK9CDK6 | |
| SCHEMBL5741646 | 0.69 | CDK4 (0.81) | CDK4CCND1CCNT1CDK9CDK6 |
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 |