Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 4/20 | 0.39 |
| ▸ | CDK2 | P24941 | 4/20 | 0.39 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.39 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.39 |
| ▸ | HPRT1 | P00492 | 7/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | PI4KA | P42356 | 1/20 | 0.37 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.37 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.37 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PDE2A | O00408 | 1/20 | 0.35 |
| ▸ | PDE9A | O76083 | 2/20 | 0.35 |
| ▸ | PRKACA | P17612 | 1/20 | 0.33 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.33 |
| ▸ | PRKACG | P22612 | 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 | |
|---|---|---|---|---|
| SCHEMBL24434435 | 0.85 | ADORA2A (0.59) | CDK1CDK2CCNB1CCNE1ADORA2A | |
| SCHEMBL25469093 | 0.82 | KDM4E (0.43) | CDK1CDK2CCNB1CCNE1ADORA2A | |
| SCHEMBL784333 | 0.82 | ADORA2A (0.51) | CDK1CDK2CCNB1CCNE1HPRT1 | |
| SCHEMBL17282460 | 0.79 | CDK2 (0.44) | CDK1CDK2CCNB1CCNE1ADORA2A | |
| SCHEMBL23228187 | 0.77 | HPRT1 (0.45) | HPRT1 | |
| SCHEMBL25468187 | 0.75 | CDK2 (0.41) | CDK1CDK2CCNB1CCNE1ADORA2A | |
| SCHEMBL24767728 | 0.74 | MEN1 (0.55) | CDK1CDK2CCNB1CCNE1MEN1 | |
| SCHEMBL15763710 | 0.73 | CDK5 (0.48) | CDK1CDK2CCNB1CCNE1ADORA2A | |
| SCHEMBL2385929 | 0.73 | HPRT1 (0.55) | CDK1CDK2CCNB1CCNE1HPRT1 | |
| SCHEMBL21011193 | 0.71 | KDM4E (0.44) | CDK1CDK2CCNB1CCNE1ALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023028350-A1 | THERAPEUTIC COMPOSITIONS AND RELATED METHODS | BOYCE THOMPSON INSTITUTE FOR PLANT RESEARCH, INC. (US) | 2023-03-02 | — | — | WO | disclosed |