Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 3/20 | 0.44 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | XDH | P47989 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.35 |
| ▸ | CDK5R1 | Q15078 | 3/20 | 0.35 |
| ▸ | DDX3X | O00571 | 1/20 | 0.35 |
| ▸ | CCNE2 | O96020 | 4/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 4/20 | 0.33 |
| ▸ | CDK2 | P24941 | 4/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.33 |
| ▸ | INSR | P06213 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6203872 | 0.91 | CDK1 (0.44) | CDK1GAAMEN1KMT2ACDK5 | |
| SCHEMBL6205009 | 0.89 | CDK5 (0.44) | CDK1MEN1KMT2ACDK5CDK5R1 | |
| SCHEMBL6203387 | 0.82 | CCNE2 (0.38) | CDK1CDK5CDK5R1CCNE2CCNE1 | |
| SCHEMBL6205532 | 0.81 | CDK5 (0.35) | CDK1CDK5CDK5R1CCNE2CCNE1 | |
| SCHEMBL6202790 | 0.81 | CDK5 (0.35) | CDK1CDK5CDK5R1CCNE2CCNE1 | |
| SCHEMBL6206176 | 0.80 | CDK5 (0.49) | CDK1MEN1KMT2ACDK5CDK5R1 | |
| SCHEMBL3444586 | 0.80 | CDK1 (0.63) | CDK1GAAMEN1KMT2AXDH | |
| SCHEMBL3445408 | 0.78 | CDK1 (0.44) | CDK1CTNNB1GAAMEN1KMT2A | |
| SCHEMBL3445200 | 0.78 | CDK1 (0.49) | CDK1CDK5CDK5R1CCNE2CCNE1 | |
| SCHEMBL6201043 | 0.77 | CDK1 (0.40) | CDK1CTNNB1GAAMEN1KMT2A |
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-1539760-A2 | AZAPURINE DERIVATIVES | INSTITUTE OF EXPERIMENTAL BOTANY ASCR (CZ) | 2005-06-15 | — | — | EP | disclosed |
| WO-2004018473-A2 | AZAPURINE DERIVATIVES | INSTITUTE OF EXPERIMENTAL BOTANY ASCR (CZ) | 2004-03-04 | — | — | WO | disclosed |