Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STS | P08842 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.33 |
| ▸ | HSD11B2 | P80365 | 2/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL9842090 | 0.94 | CNR1 (0.37) | STSHSD11B1HSD11B2CYP19A1CNR1 | |
| Fluoride SCHEMBL9841591 | 0.94 | CNR1 (0.37) | STSHSD11B1HSD11B2CYP19A1CNR1 | |
| Fluoride SCHEMBL9841426 | 0.90 | SLC6A4 (0.31) | SLC6A4SLC6A3 | |
| SCHEMBL10535362 | 0.81 | CNR1 (0.37) | STSHSD11B1HSD11B2OPRM1OPRL1 | |
| Fluoride SCHEMBL9841443 | 0.79 | HSD11B1 (0.37) | STSHSD11B1HSD11B2SLC6A4SLC6A3 | |
| SCHEMBL9841327 | 0.78 | KDM1A (0.37) | STSHSD11B1HSD11B2OPRM1OPRL1 | |
| SCHEMBL10585760 | 0.77 | P2RY6 (0.38) | STSHSD11B1HSD11B2 | |
| SCHEMBL7019483 | 0.77 | ESR1 (0.41) | HSD11B1HSD11B2SLC6A2SLC6A4SLC6A3 | |
| Fluoride SCHEMBL9841686 | 0.76 | MEN1 (0.35) | OPRM1SLC6A2SLC6A4 | |
| Fluoride SCHEMBL9842034 | 0.76 | SCN9A (0.35) | STSCYP2D6KCNH2 |
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-5055223-A | For use in liquid crystal display elements | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-10-08 | — | — | US | disclosed |