Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 17/20 | 0.62 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.49 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL2448185 | 1.00 | KCNH2 (0.62) | KCNH2KCNQ1CACNA1C | |
| SCHEMBL2447664 | 0.92 | KCNH2 (0.57) | KCNH2KCNQ1CACNA1C | |
| SCHEMBL2447658 | 0.92 | KCNH2 (0.57) | KCNH2KCNQ1CACNA1C | |
| SCHEMBL1074325 | 0.89 | KCNH2 (0.69) | KCNH2KCNQ1CACNA1C | |
| SCHEMBL2446457 | 0.89 | KCNH2 (0.49) | KCNH2 | |
| SCHEMBL2446459 | 0.89 | KCNH2 (0.49) | KCNH2 | |
| SCHEMBL1267277 | 0.87 | KCNH2 (0.56) | KCNH2KCNQ1CACNA1C | |
| SCHEMBL1266381 | 0.84 | KCNH2 (0.53) | KCNH2KCNQ1CACNA1C | |
| SCHEMBL1267369 | 0.84 | KCNH2 (0.53) | KCNH2KCNQ1CACNA1C | |
| SCHEMBL1267566 | 0.83 | KCNH2 (0.59) | KCNH2KCNQ1CACNA1C |
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-8012961-B2 | Tricyclic antibiotics | ACTELION PHARMACEUTICAL LTD. (CH) | 2011-09-06 | — | — | US | disclosed |