Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.42 |
| ▸ | MEN1 | O00255 | 5/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | XBP1 | P17861 | 1/20 | 0.42 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | TDO2 | P48775 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3297829 | 0.87 | ALDH1A1 (0.46) | MEN1KMT2ALMNAGAASGMS2 | |
| SCHEMBL8790518 | 0.82 | ALDH1A1 (0.55) | MAPTMEN1KMT2ALMNASMN1; SMN2 | |
| SCHEMBL3292771 | 0.82 | ALDH1A1 (0.46) | MAPTMEN1KMT2ALMNASMN1; SMN2 | |
| SCHEMBL3297751 | 0.82 | ALDH1A1 (0.37) | MEN1KMT2ALMNAGAASGMS2 | |
| SCHEMBL3294115 | 0.82 | KDM4E (0.42) | MEN1KMT2ALMNASMN1; SMN2KDM4E | |
| SCHEMBL3321415 | 0.78 | ALDH1A1 (0.63) | MAPTMEN1KMT2ALMNASMN1; SMN2 | |
| SCHEMBL3296473 | 0.78 | KCNH3 (0.43) | MEN1KMT2ALMNASMN1; SMN2TP53 | |
| SCHEMBL28968153 | 0.78 | MAPT (0.40) | MAPTMEN1KMT2ALMNASMN1; SMN2 | |
| SCHEMBL28968158 | 0.78 | MAPT (0.40) | MAPTMEN1KMT2ALMNASMN1; SMN2 | |
| SCHEMBL3292777 | 0.76 | CYP3A4 (0.46) | MAPTMEN1KMT2ALMNASMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7732365-B2 | Enantioselective amination and etherification | YALE UNIVERSITY (US) | 2010-06-08 | — | — | US | disclosed |
| US-20060199728-A1 | Enantioselective amination and etherification | YALE UNIVERSITY (US) | 2006-09-07 | — | — | US | disclosed |
| WO-2004024684-A2 | ENANTIOSELECTIVE AMINATION AND ETHERIFICATION | YALE UNIVERSITY (US) | 2004-03-25 | — | — | WO | disclosed |