Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNE1 | P15382 | 3/20 | 0.47 |
| ▸ | KCNQ1 | P51787 | 3/20 | 0.47 |
| ▸ | TRPV1 | Q8NER1 | 15/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.36 |
| ▸ | CFTR | P13569 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8477514 | 0.91 | KCNE1 (0.50) | KCNE1KCNQ1TRPV1CYP3A4AKR1B1 | |
| SCHEMBL8481826 | 0.84 | ALDH1A1 (0.40) | KCNE1KCNQ1TRPV1 | |
| SCHEMBL6559266 | 0.82 | KCNE1 (0.52) | KCNE1KCNQ1TRPV1CYP3A4AKR1B1 | |
| SCHEMBL6559324 | 0.82 | KCNE1 (0.46) | KCNE1KCNQ1TRPV1CYP3A4AKR1B1 | |
| SCHEMBL7468526 | 0.81 | KCNE1 (0.49) | KCNE1KCNQ1TRPV1CYP3A4AKR1B1 | |
| SCHEMBL7474755 | 0.81 | KCNE1 (0.43) | KCNE1KCNQ1TRPV1CYP3A4 | |
| SCHEMBL7473039 | 0.81 | KCNE1 (0.47) | KCNE1KCNQ1TRPV1CYP3A4AKR1B1 | |
| SCHEMBL6558684 | 0.81 | KCNE1 (0.45) | KCNE1KCNQ1TRPV1CYP3A4AKR1B1 | |
| SCHEMBL7472489 | 0.80 | KCNE1 (0.48) | KCNE1KCNQ1TRPV1CYP3A4AKR1B1 | |
| SCHEMBL7474635 | 0.80 | KCNE1 (0.48) | KCNE1KCNQ1TRPV1CYP3A4AKR1B1 |
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 |