Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL9714815 | 0.80 | KDM4E (0.37) | AOC3CYP2C19ALDH1A1KDM4EMEN1 | |
| SCHEMBL7274049 | 0.74 | AOC3 (0.36) | AOC3CYP2C19MAPTKDM4EMEN1 | |
| Hydrochloric Acid SCHEMBL5138936 | 0.73 | AOC3 (0.41) | AOC3MEN1KMT2ASMN1; SMN2POLB | |
| SCHEMBL15713200 | 0.71 | SMN1; SMN2 (0.40) | AOC3ALDH1A1MAPTKDM4ESMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL7273717 | 0.71 | TAAR1 (0.46) | AOC3LMNAKDM4EMEN1KMT2A | |
| SCHEMBL8459648 | 0.69 | CYP2C19 (0.40) | CYP2C19ALDH1A1MAPTKDM4EMEN1 | |
| SCHEMBL28971730 | 0.66 | PTGS2 (0.52) | AOC3ALDH1A1MAPTKDM4EPOLB | |
| SCHEMBL7179592 | 0.65 | TUBB1 (0.39) | ALDH1A1LMNAMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL29740115 | 0.65 | TUBB1 (0.39) | ALDH1A1LMNAMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL7363779 | 0.65 | ALDH1A1 (0.61) | ALDH1A1LMNAMAPTKDM4EMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0285890-B1 | NEW PROCESS FOR THE SYNTHESIS OF THE ALPHA-(1-METHYLETHYL)-3,4-DIMETHOXYBENZENE-ACETONITRILE | ALFA WASSERMANN SPA (IT) | 1992-11-19 | — | — | EP | claimed |