Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Ethyl Nicotinate SCHEMBL22572550 | 0.90 | GAA (0.39) | GAAALDH1A1MAPTL3MBTL1LMNA | |
| SCHEMBL21074265 | 0.82 | MAPT (0.46) | GAAALDH1A1MAPTL3MBTL1KMT2A | |
| SCHEMBL6954439 | 0.80 | L3MBTL1 (0.44) | GAAALDH1A1MAPTL3MBTL1LMNA | |
| SCHEMBL11903908 | 0.73 | GAA (0.42) | GAAALDH1A1MAPTL3MBTL1KMT2A | |
| SCHEMBL11903904 | 0.73 | GAA (0.42) | GAAALDH1A1MAPTL3MBTL1KMT2A | |
| SCHEMBL11976727 | 0.73 | GAA (0.42) | GAAALDH1A1MAPTL3MBTL1KMT2A | |
| Ethyl Nicotinate SCHEMBL8164637 | 0.70 | L3MBTL1 (0.71) | ALDH1A1MAPTL3MBTL1LMNAKMT2A | |
| Ethyl Nicotinate SCHEMBL24853 | 0.70 | L3MBTL1 (0.71) | ALDH1A1MAPTL3MBTL1LMNAKMT2A | |
| Ethyl Nicotinate SCHEMBL1330922 | 0.70 | L3MBTL1 (0.71) | ALDH1A1MAPTL3MBTL1LMNAKMT2A | |
| Ethyl Nicotinate SCHEMBL29958752 | 0.70 | L3MBTL1 (0.71) | ALDH1A1MAPTL3MBTL1LMNAKMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3728215-A1 | PREPARATION OF RACEMIC NICOTINE BY REACTION OF ETHYL NICOTINATE WITH N-VINYLPYRROLIDONE IN THE PRESENCE OF AN ALCOHOLATE BASE AND SUBSEQUENT PROCESS STEPS | Siegfried AG (CH) | 2020-10-28 | — | — | EP | disclosed |
| EP-3710437-A1 | ENANTIOMERIC SEPARATION OF RACEMIC NICOTINE BY ADDITION OF AN O,O'-DISUBSTITUTED TARTARIC ACID ENANTIOMER | Siegfried AG (CH) | 2020-09-23 | — | — | EP | disclosed |