Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 3/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
| ▸ | MAPK10 | P53779 | 3/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | RAD52 | P43351 | 1/20 | 0.35 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.35 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.35 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.35 |
| ▸ | TYMS | P04818 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6986806 | 0.91 | MAOA (0.40) | MAOANOS3NOS2MAPK10MAPK14 | |
| SCHEMBL6986039 | 0.88 | GAA (0.41) | MAOANOS3NOS2MAPK10TDP1 | |
| SCHEMBL6983307 | 0.84 | NOS3 (0.45) | MAOANOS3NOS2MAPK10PKM | |
| SCHEMBL6986057 | 0.79 | MAOA (0.40) | MAOANOS3NOS2MAPK10PKM | |
| SCHEMBL6983448 | 0.76 | MAOA (0.39) | MAOANOS3NOS2MAPK10L3MBTL1 | |
| SCHEMBL6986047 | 0.75 | MAOA (0.43) | MAOANOS3NOS2MAPK10PKM | |
| SCHEMBL16139616 | 0.73 | TDP1 (0.53) | TDP1L3MBTL1CCNB2CDK1CCNB1 | |
| SCHEMBL6986330 | 0.72 | NOS3 (0.41) | MAOANOS3NOS2MAPK10MAPK14 | |
| SCHEMBL30710409 | 0.72 | TDP1 (0.45) | MAOANOS3NOS2MAPK10MAPK14 | |
| SCHEMBL6986316 | 0.72 | MAOA (0.43) | MAOANOS3NOS2MAPK10PKM |
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 |