Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 8/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 6/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HTR1B | P28222 | 2/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5072033 | 0.83 | SLC6A2 (0.53) | ALDH1A1CYP1A2CYP2C19SLC6A4SLC6A2 | |
| SCHEMBL3276466 | 0.78 | CYP1A2 (0.51) | ALDH1A1CYP1A2CYP2C19CYP2C9SLC6A4 | |
| SCHEMBL5608953 | 0.77 | ALDH1A1 (0.55) | ALDH1A1CYP1A2CYP2C19CYP2C9SLC6A4 | |
| SCHEMBL1356983 | 0.77 | HTR1B (0.47) | ALDH1A1CYP1A2CYP2C19CYP2C9SLC6A4 | |
| SCHEMBL8009191 | 0.76 | CYP1A2 (0.49) | ALDH1A1CYP1A2CYP2C19CYP2C9SLC6A4 | |
| SCHEMBL11577421 | 0.76 | KDM4E (0.52) | ALDH1A1CYP1A2CYP2C19SLC6A4SLC6A2 | |
| SCHEMBL27258545 | 0.74 | ALDH1A1 (0.52) | ALDH1A1CYP1A2CYP2C19CYP2C9SLC6A4 | |
| SCHEMBL9669273 | 0.73 | ALDH1A1 (0.67) | ALDH1A1CYP1A2CYP2C19CYP2C9SLC6A4 | |
| SCHEMBL6008494 | 0.73 | ALDH1A1 (0.67) | ALDH1A1CYP1A2CYP2C19CYP2C9SLC6A4 | |
| SCHEMBL27613071 | 0.73 | HTR1B (0.47) | ALDH1A1CYP1A2CYP2C19CYP2C9SLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-7696374-B2 | Arylalklcarbamate derivatives, preparation method thereof and use of same in therapeutics | SANOFI-AVENTIS (FR) | 2010-04-13 | — | — | US | claimed |