Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 2/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 3/20 | 0.41 |
| ▸ | HTR1A | P08908 | 3/20 | 0.39 |
| ▸ | HTR7 | P34969 | 3/20 | 0.39 |
| ▸ | MAPK10 | P53779 | 4/20 | 0.35 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | RAD52 | P43351 | 1/20 | 0.34 |
| ▸ | TYMS | P04818 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPK14 | Q16539 | 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 | |
|---|---|---|---|---|
| SCHEMBL6986047 | 0.80 | MAOA (0.43) | NOS3NOS2MAOAHTR1AHTR7 | |
| SCHEMBL6983307 | 0.79 | NOS3 (0.45) | NOS3NOS2MAOAHTR1AHTR7 | |
| SCHEMBL6986039 | 0.74 | GAA (0.41) | NOS3NOS2MAOAHTR1AHTR7 | |
| SCHEMBL13651006 | 0.74 | MAOA (0.60) | MAOAMAPK10NISCHPKMRAD52 | |
| SCHEMBL84899 | 0.73 | MAOA (0.44) | NOS3NOS2MAOAHTR1AHTR7 | |
| SCHEMBL6985896 | 0.73 | MAOA (0.44) | NOS3NOS2MAOAMAPK10MAPT | |
| SCHEMBL6987417 | 0.73 | MAPT (0.54) | NOS3NOS2MAOAMAPK10NISCH | |
| SCHEMBL6983448 | 0.72 | MAOA (0.39) | NOS3NOS2MAOAHTR1AHTR7 | |
| SCHEMBL6983460 | 0.72 | MAOA (0.39) | NOS3NOS2MAOAHTR1AHTR7 | |
| SCHEMBL4114094 | 0.71 | NOS3 (0.49) | NOS3NOS2MAOAHTR1AHTR7 |
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 |
|---|---|---|---|---|---|---|---|
| US-8183378-B2 | Ligands, their preparation and uses thereof in asymmetric reactions | Li, Chao-Jun (CA) | 2012-05-22 | — | — | US | disclosed |