Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3A | P49840 | 19/20 | 0.69 |
| ▸ | GSK3B | P49841 | 19/20 | 0.69 |
| ▸ | CDK1 | P06493 | 18/20 | 0.69 |
| ▸ | CCNB2 | O95067 | 17/20 | 0.69 |
| ▸ | CCNB1 | P14635 | 17/20 | 0.69 |
| ▸ | CCNB3 | Q8WWL7 | 17/20 | 0.69 |
| ▸ | CDK5 | Q00535 | 11/20 | 0.69 |
| ▸ | CDK5R1 | Q15078 | 10/20 | 0.69 |
| ▸ | MAPK8 | P45983 | 3/20 | 0.66 |
| ▸ | CDK2 | P24941 | 3/20 | 0.66 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.66 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.66 |
| ▸ | INSR | P06213 | 1/20 | 0.66 |
| ▸ | CFTR | P13569 | 1/20 | 0.66 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.66 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.66 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.66 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.66 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.66 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.66 |
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 | |
|---|---|---|---|---|
| SCHEMBL1778932 | 0.90 | GSK3A (0.69) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL1778366 | 0.86 | GSK3A (0.70) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL1779346 | 0.86 | GSK3A (0.70) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL1779469 | 0.85 | GSK3A (0.69) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL7253083 | 0.82 | GSK3A (0.53) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| Bromide SCHEMBL490395 | 0.81 | GSK3A (0.97) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL27594653 | 0.81 | GSK3A (0.70) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| Aloisine A SCHEMBL80147 | 0.80 | GSK3A (1.00) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL1777822 | 0.80 | GSK3A (0.72) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL1777268 | 0.78 | GSK3A (0.69) | 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 |