Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 1/20 | 0.36 |
| ▸ | ADH1B | P00325 | 2/20 | 0.34 |
| ▸ | ADH1A | P07327 | 2/20 | 0.34 |
| ▸ | ADH7 | P40394 | 2/20 | 0.34 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | HTR3A | P46098 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | CDYL | Q9Y232 | 1/20 | 0.34 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9868336 | 0.86 | PAOX (0.37) | ADH1BADH1AADH7CYP2D6LMNA | |
| SCHEMBL18265593 | 0.79 | NAAA (0.45) | NAAAADH1BADH1AADH7CYP1A2 | |
| SCHEMBL11856688 | 0.79 | NAAA (0.48) | NAAADNM1CYP2D6LMNACYP1A2 | |
| SCHEMBL3318173 | 0.78 | ADH1B (0.40) | ADH1BADH1AADH7PAOXALDH1A1 | |
| SCHEMBL23486781 | 0.77 | MEN1 (0.39) | ADH1BADH1AADH7PAOXCHRM2 | |
| SCHEMBL64491 | 0.75 | NAAA (0.52) | NAAADNM1CYP2D6LMNACYP1A2 | |
| SCHEMBL93173 | 0.75 | ADH1B (0.52) | ADH1BADH1AADH7LMNATSHR | |
| SCHEMBL3319760 | 0.74 | ADH1B (0.43) | ADH1BADH1AADH7LMNACYP1A2 | |
| Acetic Acid SCHEMBL28377700 | 0.74 | CYP2D6 (0.47) | NAAACYP2D6LMNACYP1A2TSHR | |
| Formic Acid SCHEMBL8171729 | 0.74 | ADH1B (0.46) | ADH1BADH1AADH7CYP2D6LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991011448-A1 | THERAPEUTIC AGENTS | THE BOOTS COMPANY PLC (GB) | 1991-08-08 | — | — | WO | disclosed |