Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 19/20 | 0.48 |
| ▸ | GSK3A | P49840 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 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 | |
|---|---|---|---|---|
| SCHEMBL16115154 | 0.92 | CNR2 (0.50) | CNR2GSK3AGSK3B | |
| SCHEMBL15776333 | 0.86 | CNR2 (0.45) | CNR2GSK3AGSK3B | |
| Formic Acid SCHEMBL28069002 | 0.78 | CNR2 (0.59) | CNR2CNR1 | |
| SCHEMBL19225465 | 0.73 | CNR2 (0.56) | CNR2 | |
| SCHEMBL15776679 | 0.72 | CNR2 (0.46) | CNR2CNR1 | |
| SCHEMBL28026381 | 0.72 | CNR2 (0.44) | CNR2GSK3B | |
| SCHEMBL29423350 | 0.70 | CNR2 (0.70) | CNR2CNR1 | |
| SCHEMBL15776331 | 0.70 | CNR2 (0.70) | CNR2CNR1 | |
| Formic Acid SCHEMBL28041269 | 0.69 | CYP17A1 (0.40) | — | |
| SCHEMBL12689606 | 0.69 | GSK3B (0.41) | CNR2GSK3AGSK3B |
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 |
|---|---|---|---|---|---|---|---|
| CN-105121436-B | New pyridine derivate | 豪夫迈·罗氏有限公司 | 2018-07-27 | — | — | CN | disclosed |