Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 5/20 | 0.31 |
| ▸ | ADRA2B | P18089 | 5/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 5/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.31 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.31 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | ACP3 | P15309 | 1/20 | 0.31 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29031369 | 0.76 | ALDH1A1 (0.48) | ALDH1A1CYP2C9CYP2C19CYP1A2CA1 | |
| SCHEMBL9646346 | 0.75 | ALDH1A1 (0.47) | ALDH1A1CYP2C9CYP2C19CYP1A2CA1 | |
| SCHEMBL29031364 | 0.73 | ALDH1A1 (0.43) | ALDH1A1CYP2C9CYP2C19CYP1A2ADRA2A | |
| SCHEMBL7595550 | 0.70 | ALDH1A1 (0.54) | ALDH1A1CYP2C9CYP2C19CYP1A2CA1 | |
| SCHEMBL1325907 | 0.68 | TRPA1 (0.32) | — | |
| SCHEMBL11043031 | 0.68 | ALDH1A1 (0.43) | ALDH1A1CYP2C9CYP2C19CYP1A2ADRA2A | |
| SCHEMBL5692111 | 0.67 | ALDH1A1 (0.55) | ALDH1A1CYP2C9CYP2C19CYP1A2CA1 | |
| SCHEMBL12238420 | 0.67 | ALDH1A1 (0.50) | ALDH1A1CYP2C9CYP2C19CYP1A2CA1 | |
| SCHEMBL5692140 | 0.67 | ALDH1A1 (0.50) | ALDH1A1CYP2C9CYP2C19CYP1A2CA1 | |
| SCHEMBL1527193 | 0.67 | ALDH1A1 (0.50) | ALDH1A1CYP2C9CYP2C19CYP1A2CA1 |
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-0512020-A1 | PROCESS FOR PREPARING HOMOCHIRAL AMINES AND PROCESS FOR PREPARING INTERMEDIATES FOR THE PREPARATION THEREOF | Nobel Chemicals AB (SE) | 1992-11-11 | — | — | EP | claimed |
| WO-1991010642-A1 | PROCESS FOR PREPARING HOMOCHIRAL AMINES AND PROCESS FOR PREPARING INTERMEDIATES FOR THE PREPARATION THEREOF, AND THE INTERMEDIATES PREPARED IN ACCORDANCE WITH THIS PROCESS | NOBEL CHEMICALS AB (SE) | 1991-07-25 | — | — | WO | claimed |