Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 16/20 | 0.47 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.45 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4403022 | 0.89 | CDK8 (0.47) | GSK3BDYRK1A | |
| SCHEMBL2671627 | 0.84 | AAK1 (0.52) | GSK3BDYRK1AAAK1HDAC6 | |
| SCHEMBL2671796 | 0.81 | MAP2K4 (0.53) | DYRK1AHDAC6 | |
| SCHEMBL25139495 | 0.81 | ABL1 (0.51) | — | |
| SCHEMBL4150213 | 0.80 | DYRK1A (0.45) | GSK3BDYRK1AAAK1HDAC6 | |
| SCHEMBL4402972 | 0.77 | MEN1 (0.45) | — | |
| SCHEMBL13810906 | 0.76 | AAK1 (0.67) | GSK3BAAK1HDAC6 | |
| SCHEMBL27909188 | 0.74 | GSK3B (0.54) | GSK3BDYRK1A | |
| SCHEMBL12388929 | 0.74 | GSK3B (0.50) | GSK3BDYRK1A | |
| SCHEMBL4403122 | 0.72 | MAPK1 (0.43) | CYP1A2 |
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-2012056372-A1 | N1/N2-LACTAM ACETYL-CoA CARBOXYLASE INHIBITORS | PFIZER INC. (US) | 2012-05-03 | — | — | WO | disclosed |