Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28219902 | 0.78 | CHRNB2 (0.56) | MAOB | |
| SCHEMBL23301041 | 0.77 | MAPT (0.47) | HDAC1HDAC8HDAC6HDAC5 | |
| SCHEMBL24271048 | 0.72 | CYP2D6 (0.52) | — | |
| SCHEMBL28193581 | 0.71 | KCNA3 (0.62) | MAOBHDAC1HDAC8HDAC6HDAC5 | |
| SCHEMBL4322475 | 0.70 | ALDH1A1 (0.48) | PDK2 | |
| SCHEMBL10158177 | 0.70 | CA12 (0.42) | — | |
| SCHEMBL29093458 | 0.69 | NR5A1 (0.50) | — | |
| SCHEMBL2567562 | 0.69 | LTA4H (0.55) | MAOBAPPHDAC6 | |
| SCHEMBL7784617 | 0.69 | MAOB (0.53) | MAOB | |
| SCHEMBL23036856 | 0.69 | MAOB (0.42) | MAOBMAOAAPP |
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-109153664-A | Pyridinyl derivatives, pharmaceutical composition and its purposes as 3 inhibitor of copper-containing amine oxidases | 勃林格殷格翰国际有限公司 | 2019-01-04 | — | — | CN | disclosed |