Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3A | P49840 | 18/20 | 0.53 |
| ▸ | GSK3B | P49841 | 18/20 | 0.53 |
| ▸ | CDK1 | P06493 | 17/20 | 0.53 |
| ▸ | CCNB2 | O95067 | 16/20 | 0.53 |
| ▸ | CCNB1 | P14635 | 16/20 | 0.53 |
| ▸ | CCNB3 | Q8WWL7 | 16/20 | 0.53 |
| ▸ | CDK5 | Q00535 | 11/20 | 0.53 |
| ▸ | CDK5R1 | Q15078 | 10/20 | 0.53 |
| ▸ | CDK2 | P24941 | 3/20 | 0.51 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.51 |
| ▸ | ZAP70 | P43403 | 1/20 | 0.51 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.51 |
| ▸ | MAPK8 | P45983 | 3/20 | 0.46 |
| ▸ | AURKA | O14965 | 2/20 | 0.46 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.46 |
| ▸ | PAK4 | O96013 | 2/20 | 0.46 |
| ▸ | ABL1 | P00519 | 2/20 | 0.46 |
| ▸ | FYN | P06241 | 2/20 | 0.46 |
| ▸ | RET | P07949 | 2/20 | 0.46 |
| ▸ | KDR | P35968 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL1777932 | 0.89 | GSK3A (0.49) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL7253117 | 0.82 | GSK3A (0.69) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL1777822 | 0.79 | GSK3A (0.72) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL1777268 | 0.75 | GSK3A (0.69) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL1777025 | 0.74 | GSK3A (0.55) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL6846771 | 0.74 | GSK3A (0.61) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL12605846 | 0.74 | GSK3A (0.67) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL2257211 | 0.73 | F2RL1 (0.46) | — | |
| SCHEMBL1778932 | 0.72 | GSK3A (0.69) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL1778473 | 0.72 | GSK3A (0.54) | GSK3AGSK3BCDK1CCNB2CCNB1 |
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-2003000690-A1 | SYNTHESIS OF HETEROCYCLIC COMPOUNDS EMPLOYING MICROWAVE TECHNOLOGY | AVENTIS PHARMACEUTICALS INC. (US) | 2003-01-03 | — | — | WO | disclosed |