Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 6/20 | 0.51 |
| ▸ | CCND1 | P24385 | 6/20 | 0.51 |
| ▸ | CCNE2 | O96020 | 5/20 | 0.51 |
| ▸ | CCNE1 | P24864 | 5/20 | 0.51 |
| ▸ | CDK2 | P24941 | 5/20 | 0.51 |
| ▸ | CAMK2B | Q13554 | 4/20 | 0.51 |
| ▸ | CAMK2G | Q13555 | 4/20 | 0.51 |
| ▸ | CAMK2D | Q13557 | 4/20 | 0.51 |
| ▸ | CAMK2A | Q9UQM7 | 4/20 | 0.51 |
| ▸ | CCNB2 | O95067 | 4/20 | 0.51 |
| ▸ | CDK1 | P06493 | 4/20 | 0.51 |
| ▸ | CCNB1 | P14635 | 4/20 | 0.51 |
| ▸ | CCNB3 | Q8WWL7 | 4/20 | 0.51 |
| ▸ | PRKACA | P17612 | 2/20 | 0.51 |
| ▸ | PRKACG | P22612 | 2/20 | 0.51 |
| ▸ | PRKACB | P22694 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | GABRP | O00591 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL29755092 | 1.00 | CDK4 (0.51) | CDK4CCND1CCNE2CCNE1CDK2 | |
| SCHEMBL23926188 | 0.85 | CDK4 (0.50) | CDK4CCND1CCNE2CCNE1CDK2 | |
| SCHEMBL4901329 | 0.85 | IMPDH2 (0.55) | CDK4CCND1CCNE2CCNE1CDK2 | |
| SCHEMBL22787315 | 0.85 | CDK4 (0.47) | CDK4CCND1CCNE2CCNE1CDK2 | |
| SCHEMBL5022753 | 0.81 | MAPT (0.63) | CDK4CCND1CCNE2CCNE1CDK2 | |
| SCHEMBL22079859 | 0.81 | MAPT (0.59) | CDK4CCND1CCNE2CCNE1CDK2 | |
| SCHEMBL14619930 | 0.78 | MEN1 (0.53) | CDK4CCND1CCNE2CCNE1CDK2 | |
| SCHEMBL30300692 | 0.78 | CDK4 (0.42) | CDK4CCND1CCNE2CCNE1CDK2 | |
| SCHEMBL145695 | 0.78 | PIM1 (0.50) | CDK4CCND1CCNE2CCNE1CDK2 | |
| SCHEMBL24732232 | 0.77 | DYRK1A (0.51) | CDK4CCND1CCNE2CCNE1CDK2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114644638-B | Nitrogen-containing heterocyclic compound and application thereof | 广州华睿光电材料有限公司 | 2024-04-23 | — | — | CN | disclosed |
| CN-114644638-A | Nitrogen-containing heterocyclic compound and application thereof | 广州华睿光电材料有限公司 | 2022-06-21 | — | — | CN | disclosed |