Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.49 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.49 |
| ▸ | PDE4A | P27815 | 1/20 | 0.49 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.48 |
| ▸ | ABCC2 | Q92887 | 1/20 | 0.43 |
| ▸ | FAP | Q12884 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22429130 | 1.00 | ESR1 (0.49) | ESR1PTGS1PDE4ACACNA1CABCC2 | |
| SCHEMBL26679026 | 1.00 | ESR1 (0.49) | ESR1PTGS1PDE4ACACNA1CABCC2 | |
| SCHEMBL19374295 | 0.92 | ESR1 (0.51) | ESR1PTGS1PDE4ACACNA1CABCC2 | |
| SCHEMBL22429513 | 0.92 | ESR1 (0.52) | ESR1PTGS1PDE4ACACNA1CABCC2 | |
| SCHEMBL22429667 | 0.92 | ESR1 (0.52) | ESR1PTGS1PDE4ACACNA1CABCC2 | |
| SCHEMBL24041092 | 0.92 | ESR1 (0.52) | ESR1PTGS1PDE4ACACNA1CABCC2 | |
| SCHEMBL22429568 | 0.92 | ESR1 (0.52) | ESR1PTGS1PDE4ACACNA1CABCC2 | |
| SCHEMBL26678863 | 0.92 | ESR1 (0.52) | ESR1PTGS1PDE4ACACNA1CABCC2 | |
| SCHEMBL22429225 | 0.92 | ESR1 (0.52) | ESR1PTGS1PDE4ACACNA1CABCC2 | |
| SCHEMBL26679132 | 0.92 | ESR1 (0.52) | ESR1PTGS1PDE4ACACNA1CABCC2 |
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-3430013-B1 | CARBAPENEM COMPOUNDS | ORCHID PHARMA LTD (IN) | 2023-11-15 | — | — | EP | disclosed |