Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL499218 | 0.64 | ALDH1A1 (0.31) | CYP1A2 | |
| SCHEMBL12631734 | 0.57 | — | — | |
| SCHEMBL9432184 | 0.57 | CYP1A2 (0.61) | CYP1A2 | |
| SCHEMBL2292104 | 0.57 | CYP1A2 (0.35) | CYP1A2 | |
| SCHEMBL3533245 | 0.56 | ALDH1A1 (0.30) | CYP1A2 | |
| SCHEMBL7492856 | 0.56 | — | — | |
| SCHEMBL9852982 | 0.55 | PDPK1 (0.43) | CYP1A2 | |
| SCHEMBL7607691 | 0.54 | CCNA2 (0.47) | CYP1A2 | |
| SCHEMBL11390829 | 0.52 | — | — | |
| SCHEMBL11017179 | 0.52 | CYP1A2 (0.80) | CYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5171860-A | Diamino isothiazole-1-oxides and 1,1 dioxides as gastric secretion inhibitors | MERCK & CO., INC. (US) | 1992-12-15 | — | — | US | disclosed |
| EP-0067436-B1 | DIAMINO ISOTHIAZOLE -1-OXIDES AND -1,1-DIOXIDES AS GASTRIC SECRETION INHIBITORS | MERCK & CO. INC. (US) | 1986-07-23 | — | — | EP | disclosed |
| EP-0067436-A2 | Diamino isothiazole -1-oxides and -1,1-dioxides as gastric secretion inhibitors | MERCK & CO. INC. (US) | 1982-12-22 | — | — | EP | disclosed |