Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNE1 | P15382 | 3/20 | 0.47 |
| ▸ | KCNQ1 | P51787 | 3/20 | 0.47 |
| ▸ | KCNA5 | P22460 | 9/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.35 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.33 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8477352 | 0.79 | KCNE1 (0.45) | KCNE1KCNQ1KCNA5TRPV1 | |
| SCHEMBL7481178 | 0.65 | ABCC9 (0.66) | ABCC9 | |
| SCHEMBL7482702 | 0.65 | ABCC9 (0.66) | ABCC9 | |
| SCHEMBL7481173 | 0.65 | ABCC9 (0.66) | ABCC9 | |
| SCHEMBL7481161 | 0.62 | ABCB1 (0.46) | KCNE1KCNQ1ABCB1ABCC9 | |
| SCHEMBL7479217 | 0.62 | ABCB1 (0.46) | KCNE1KCNQ1ABCB1ABCC9 | |
| SCHEMBL7475685 | 0.62 | ABCC9 (0.59) | ABCC9 | |
| SCHEMBL7475675 | 0.62 | ABCC9 (0.59) | ABCC9 | |
| SCHEMBL7477937 | 0.62 | ABCC9 (0.59) | ABCC9 | |
| SCHEMBL7479224 | 0.62 | ABCB1 (0.46) | KCNE1KCNQ1ABCB1ABCC9 |
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-5955607-A | TREATING CARDIOVASCULAR AND GASTROINTESTINAL DISORDERS | HOECHST MARION ROUSSEL DEUTSCHLAND (DE) | 1999-09-21 | — | — | US | disclosed |