Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.44 |
| ▸ | AOC1 | P19801 | 2/20 | 0.43 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.43 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.42 |
| ▸ | LATS1 | O95835 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.37 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3433340 | 0.84 | AOC1 (0.47) | SLC22A12AOC1AOC3KDM4CALDH1A1 | |
| Hydrochloric Acid SCHEMBL1964472 | 0.82 | AOC1 (0.49) | SLC22A12AOC1AOC3KDM4CALDH1A1 | |
| SCHEMBL17980965 | 0.77 | GAA (0.44) | SLC22A12ALDH1A1MAPK1GAAKDM4E | |
| SCHEMBL24435813 | 0.74 | SLC22A12 (0.50) | SLC22A12 | |
| SCHEMBL4754435 | 0.73 | AOC1 (0.57) | AOC1AOC3KDM4CMAPK1CYP3A4 | |
| SCHEMBL20772453 | 0.73 | KIF11 (0.41) | SLC22A12KDM4CLATS1ALDH1A1GAA | |
| SCHEMBL30448578 | 0.73 | AOC1 (0.57) | AOC1AOC3KDM4CMAPK1CYP3A4 | |
| SCHEMBL22455897 | 0.73 | SLC22A12 (0.49) | SLC22A12CYP17A1 | |
| SCHEMBL6361945 | 0.73 | MAPK1 (0.45) | SLC22A12ALDH1A1MAPK1GAAKDM4E | |
| SCHEMBL18986531 | 0.72 | — | — |
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-2012038081-A1 | SUBSTITUTED BENZAMIDE COMPOUNDS | Grünenthal GmbH (DE) | 2012-03-29 | — | — | WO | disclosed |