Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | ADH1B | P00325 | 1/20 | 0.30 |
| ▸ | ADH1C | P00326 | 1/20 | 0.30 |
| ▸ | ADH1A | P07327 | 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 | |
|---|---|---|---|---|
| SCHEMBL20280407 | 0.82 | ADH1B (0.42) | CYP2D6ADH1BADH1CADH1A | |
| SCHEMBL2243774 | 0.79 | ALDH1A1 (0.35) | ALDH1A1 | |
| SCHEMBL14504517 | 0.77 | BCHE (0.36) | ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL14503982 | 0.77 | BCHE (0.36) | ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL14504512 | 0.77 | BCHE (0.36) | ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL28783671 | 0.75 | ALDH1A1 (0.32) | ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL27735943 | 0.75 | ALDH1A1 (0.32) | ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL2250950 | 0.74 | — | — | |
| SCHEMBL2246630 | 0.74 | — | — | |
| SCHEMBL6167791 | 0.73 | CYP1A2 (0.35) | ALDH1A1CYP1A2CYP2D6 |
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-3294803-A1 | CATALYST CONTAINING GUANIDINE GROUPS | Sika Technology AG (CH) | 2018-03-21 | — | — | EP | disclosed |