Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 7/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL11684199 | 1.00 | KCNH2 (0.33) | KCNH2HRH3CA12CA2CA9 | |
| Hydrochloric Acid SCHEMBL22771780 | 0.89 | KCNH2 (0.30) | KCNH2 | |
| Hydrochloric Acid SCHEMBL22771779 | 0.89 | KCNH2 (0.30) | KCNH2 | |
| SCHEMBL15901521 | 0.87 | CA12 (0.31) | CA12CA2CA9 | |
| SCHEMBL15901522 | 0.87 | CA12 (0.31) | CA12CA2CA9 | |
| SCHEMBL23422693 | 0.85 | TSHR (0.32) | HRH3 | |
| SCHEMBL15901538 | 0.85 | TSHR (0.32) | HRH3 | |
| Hydrochloric Acid SCHEMBL22575281 | 0.83 | TSHR (0.31) | — | |
| Hydrochloric Acid SCHEMBL22771713 | 0.83 | TSHR (0.31) | — | |
| SCHEMBL9458696 | 0.83 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4025653-A | Microbiocidal polymeric quaternary ammonium compounds | MILLMASTER ONYX CORPORATION (US) | 1977-05-24 | — | — | US | claimed |