Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.68 |
| ▸ | AOC3 | Q16853 | 6/20 | 0.63 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.54 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.54 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.50 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.50 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL16863764 | 1.00 | KDM4E (0.68) | KDM4EALDH1A1AOC3GAASLC6A2 | |
| SCHEMBL11701093 | 0.89 | KDM4E (0.59) | KDM4EALDH1A1AOC3GAASLC6A2 | |
| Methylephedrine SCHEMBL338479 | 0.81 | KDM4E (1.00) | KDM4EALDH1A1AOC3GAASLC6A2 | |
| Methylephedrine SCHEMBL11959977 | 0.81 | KDM4E (1.00) | KDM4EALDH1A1AOC3GAASLC6A2 | |
| Methylephedrine SCHEMBL338478 | 0.81 | KDM4E (1.00) | KDM4EALDH1A1AOC3GAASLC6A2 | |
| Methylephedrine SCHEMBL907677 | 0.81 | KDM4E (1.00) | KDM4EALDH1A1AOC3GAASLC6A2 | |
| Methylephedrine SCHEMBL2712293 | 0.81 | KDM4E (1.00) | KDM4EALDH1A1AOC3GAASLC6A2 | |
| Methylephedrine SCHEMBL99673 | 0.81 | KDM4E (1.00) | KDM4EALDH1A1AOC3GAASLC6A2 | |
| Methylephedrine SCHEMBL99674 | 0.81 | KDM4E (1.00) | KDM4EALDH1A1AOC3GAASLC6A2 | |
| Methylephedrine SCHEMBL7496690 | 0.81 | KDM4E (1.00) | KDM4EALDH1A1AOC3GAASLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1390340-B1 | COPPER-CATALYZED FORMATION OF CARBON-HETEROATOM AND CARBON-CARBON BONDS | MASSACHUSETTS INST TECHNOLOGY (US) | 2017-03-01 | — | — | EP | disclosed |
| WO-2012097510-A1 | PROCESS FOR PREPARATION OF EFAVIRENZ BY CYCLISATION | LONZA LTD (CH) | 2012-07-26 | — | — | WO | disclosed |
| WO-2012097511-A1 | DMP-266 BY CYCLISATION | LONZA LTD (CH) | 2012-07-26 | — | — | WO | disclosed |