Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 3/20 | 0.40 |
| ▸ | NOS3 | P29474 | 1/20 | 0.40 |
| ▸ | NOS2 | P35228 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | RAD52 | P43351 | 1/20 | 0.36 |
| ▸ | PLG | P00747 | 1/20 | 0.35 |
| ▸ | PLAU | P00749 | 1/20 | 0.35 |
| ▸ | PLAT | P00750 | 1/20 | 0.35 |
| ▸ | KLK1 | P06870 | 1/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.34 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6983307 | 0.85 | NOS3 (0.45) | MAOANOS3NOS2PKMRAD52 | |
| SCHEMBL6986806 | 0.85 | MAOA (0.40) | MAOANOS3NOS2PKMRAD52 | |
| SCHEMBL6986039 | 0.81 | GAA (0.41) | MAOANOS3NOS2PKMRAD52 | |
| SCHEMBL6986780 | 0.80 | MAOA (0.40) | MAOANOS3NOS2PKMRAD52 | |
| SCHEMBL6983460 | 0.79 | MAOA (0.39) | MAOANOS3NOS2PKMRAD52 | |
| SCHEMBL6986316 | 0.78 | MAOA (0.43) | MAOANOS3NOS2CA1CA2 | |
| SCHEMBL6986047 | 0.76 | MAOA (0.43) | MAOANOS3NOS2PKMRAD52 | |
| SCHEMBL6985896 | 0.75 | MAOA (0.44) | MAOANOS3NOS2MAPK10 | |
| SCHEMBL6992467 | 0.75 | MAOA (0.48) | MAOACA1CA2CA7CA9 | |
| SCHEMBL6983448 | 0.74 | MAOA (0.39) | MAOANOS3NOS2PKMRAD52 |
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 |