Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | TDO2 | P48775 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.31 |
| ▸ | PDK3 | Q15120 | 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 | |
|---|---|---|---|---|
| SCHEMBL3300249 | 0.76 | CA12 (0.45) | KDM4EKMT2AMEN1NPC1RAB9A | |
| SCHEMBL3297829 | 0.75 | ALDH1A1 (0.46) | KDM4EKMT2AMEN1LMNAL3MBTL1 | |
| SCHEMBL27935890 | 0.72 | MEN1 (0.46) | KDM4EKMT2AMEN1LMNAL3MBTL1 | |
| SCHEMBL18194512 | 0.70 | TSHR (0.40) | KMT2AMEN1HTTRAB9AIDO1 | |
| SCHEMBL3933907 | 0.69 | AOC3 (0.42) | ALDH1A1HTR2A | |
| SCHEMBL3294115 | 0.68 | KDM4E (0.42) | KDM4EKMT2AMEN1NPC1LMNA | |
| SCHEMBL7582089 | 0.68 | FPR2 (0.46) | KMT2AMEN1NPC1LMNAHTT | |
| SCHEMBL3297751 | 0.68 | ALDH1A1 (0.37) | KDM4EKMT2AMEN1LMNAL3MBTL1 | |
| SCHEMBL3300265 | 0.68 | MAPT (0.42) | KDM4EKMT2AMEN1LMNAHTT | |
| SCHEMBL3292771 | 0.68 | ALDH1A1 (0.46) | KMT2AMEN1LMNAHTTTP53 |
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 |