Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1C | Q13936 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.30 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | PDE4A | P27815 | 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 | |
|---|---|---|---|---|
| SCHEMBL7626750 | 1.00 | CACNA1C (0.32) | CACNA1CESR1PTGS1PDE4A | |
| SCHEMBL6891133 | 0.91 | ESR1 (0.32) | CACNA1CESR1PTGS1PDE4A | |
| SCHEMBL7626762 | 0.88 | ESR1 (0.33) | CACNA1CESR1PTGS1PDE4A | |
| SCHEMBL7628035 | 0.88 | ESR1 (0.33) | CACNA1CESR1PTGS1PDE4A | |
| SCHEMBL6886863 | 0.86 | ESR1 (0.32) | CACNA1CESR1PTGS1PDE4A | |
| SCHEMBL6889671 | 0.86 | ESR1 (0.32) | CACNA1CESR1PTGS1PDE4A | |
| SCHEMBL6893661 | 0.85 | PTGS1 (0.32) | CACNA1CESR1PTGS1PDE4A | |
| SCHEMBL6895701 | 0.83 | HDAC3 (0.35) | — | |
| SCHEMBL7722284 | 0.83 | ABCC2 (0.32) | — | |
| SCHEMBL7633400 | 0.83 | CACNA1C (0.34) | CACNA1CESR1PTGS1PDE4A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1022279-B1 | NEW CARBAPENEM DERIVATIVES | MEIJI SEIKA KAISHA (JP) | 2002-09-04 | — | — | EP | disclosed |