Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 3/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MPI | P34949 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | RAD52 | P43351 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6986780 | 0.84 | MAOA (0.40) | MAOAMAPK10ALDH1A1KDM4EGAA | |
| SCHEMBL6985896 | 0.82 | MAOA (0.44) | MAOAMAPK10ALDH1A1KDM4EGAA | |
| SCHEMBL6983448 | 0.79 | MAOA (0.39) | MAOAMAPK10ALDH1A1KDM4EGAA | |
| SCHEMBL6986057 | 0.75 | MAOA (0.40) | MAOACA1CA2CA7CA9 | |
| SCHEMBL6987417 | 0.74 | MAPT (0.54) | MAOAMAPK10ALDH1A1MAPTLMNA | |
| SCHEMBL6994458 | 0.74 | MAOA (0.34) | MAOACYP3A4 | |
| SCHEMBL1305457 | 0.73 | KDM4E (0.50) | ALDH1A1KDM4EGAAMAPTTHRB | |
| SCHEMBL13651006 | 0.73 | MAOA (0.60) | MAOAMAPK10ALDH1A1MAPTLMNA | |
| SCHEMBL29498357 | 0.73 | ALDH1A1 (0.65) | MAOACA1CA2CA7CA9 | |
| SCHEMBL12567716 | 0.73 | ALDH1A1 (0.65) | MAOACA1CA2CA7CA9 |
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 |