Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 2/20 | 0.32 |
| ▸ | DCPS | Q96C86 | 1/20 | 0.31 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10647777 | 0.85 | DYRK1A (0.40) | CYP2A6MAOADYRK1A | |
| SCHEMBL3801869 | 0.77 | NOS2 (0.38) | CYP2A6NOS3NOS2 | |
| SCHEMBL1931165 | 0.76 | LOXL2 (0.45) | CYP2A6NOS3NOS2 | |
| SCHEMBL4795960 | 0.76 | KDM4E (0.41) | CYP2A6MAOANOS3NOS2DYRK1A | |
| SCHEMBL156074 | 0.76 | CYP2A6 (0.34) | CYP2A6NOS3NOS2 | |
| SCHEMBL7396568 | 0.76 | CYP2A6 (0.34) | CYP2A6NOS3NOS2 | |
| SCHEMBL25820190 | 0.72 | GABRA1 (0.38) | CYP2A6MAOANOS3NOS2 | |
| SCHEMBL11500900 | 0.71 | CYP2D6 (0.37) | DYRK1A | |
| SCHEMBL27570675 | 0.71 | TYR (0.37) | NOS2DYRK1A | |
| SCHEMBL7696876 | 0.71 | CYP2A6 (0.31) | CYP2A6MAOA |
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-106146349-B | A kind of method that aromatic aldehyde catalyzed conversion prepares amidine | 中国科学院大连化学物理研究所 | 2018-02-13 | — | — | CN | disclosed |