Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 2/20 | 0.33 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.33 |
| ▸ | NQO1 | P15559 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.30 |
| ▸ | HSD11B2 | P80365 | 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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL9842034 | 0.91 | SCN9A (0.35) | CYP4F2CYP4A11MEN1KMT2A | |
| Fluoride SCHEMBL9841332 | 0.89 | SCN9A (0.39) | CYP4F2CYP4A11MEN1KMT2ATSHR | |
| Fluoride SCHEMBL9841281 | 0.88 | SCN9A (0.38) | CYP4F2CYP4A11MEN1KMT2ATSHR | |
| Fluoride SCHEMBL9841564 | 0.88 | SCN9A (0.38) | CYP4F2CYP4A11MEN1KMT2ATSHR | |
| Fluoride SCHEMBL9841466 | 0.88 | SCN9A (0.38) | CYP4F2CYP4A11MEN1KMT2ATSHR | |
| Fluoride SCHEMBL9841887 | 0.87 | NQO1 (0.34) | CYP4F2CYP4A11NQO1MAPTHSD11B1 | |
| SCHEMBL9841636 | 0.78 | CYP4F2 (0.32) | CYP4F2CYP4A11NQO1HSD11B1HSD11B2 | |
| Fluoride SCHEMBL9841426 | 0.75 | SLC6A4 (0.31) | — | |
| SCHEMBL9842044 | 0.70 | SCN9A (0.34) | CYP4F2CYP4A11MEN1KMT2AHSD11B1 | |
| SCHEMBL9841333 | 0.69 | SCN9A (0.38) | CYP4F2CYP4A11MEN1KMT2ATSHR |
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 |