Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | GRM6 | O15303 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | BRS3 | P32247 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 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 | |
|---|---|---|---|---|
| SCHEMBL517 | 0.87 | SLC6A3 (0.50) | SLC6A3SLC6A4SLC6A2BCAT2ALDH1A1 | |
| SCHEMBL9030773 | 0.81 | CHRNB2 (0.45) | SLC6A3SLC6A4ALDH1A1ACHEBRS3 | |
| Methylamine SCHEMBL28010440 | 0.80 | BCAT2 (0.53) | SLC6A3SLC6A4SLC6A2BCAT2ALDH1A1 | |
| SCHEMBL9531321 | 0.80 | BCAT2 (0.52) | SLC6A3SLC6A4SLC6A2BCAT2ALDH1A1 | |
| SCHEMBL29389473 | 0.80 | BCAT2 (0.52) | SLC6A3SLC6A4SLC6A2BCAT2ALDH1A1 | |
| SCHEMBL1665535 | 0.78 | SLC6A3 (0.49) | SLC6A3SLC6A4SLC6A2BCAT2ALDH1A1 | |
| Bromomethane SCHEMBL7011845 | 0.77 | SLC6A3 (0.50) | SLC6A3SLC6A4SLC6A2BCAT2ALDH1A1 | |
| SCHEMBL249 | 0.77 | SLC6A3 (0.73) | SLC6A3SLC6A4SLC6A2ALDH1A1MAPT | |
| SCHEMBL3558536 | 0.76 | SLC6A3 (0.48) | SLC6A3SLC6A4SLC6A2BCAT2ACHE | |
| SCHEMBL10533851 | 0.74 | SLC6A3 (0.65) | SLC6A3SLC6A4SLC6A2ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5336778-A | Substituted triazoles as angiotensin II antagonists | MERCK & CO., INC. (US) | 1994-08-09 | — | — | US | disclosed |
| EP-0409332-A2 | Substituted triazoles as angiotensin II antagonists | MERCK & CO. INC. (US) | 1991-01-23 | — | — | EP | disclosed |