Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.34 |
| ▸ | HSD11B2 | P80365 | 2/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | STS | P08842 | 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 | |
|---|---|---|---|---|
| SCHEMBL9842096 | 0.94 | HSD11B1 (0.37) | KDM1AHSD11B1HSD11B2CYP19A1STS | |
| SCHEMBL9841595 | 0.94 | HSD11B1 (0.37) | KDM1AHSD11B1HSD11B2CYP19A1STS | |
| SCHEMBL9841427 | 0.90 | KDM1A (0.39) | KDM1A | |
| SCHEMBL9841191 | 0.83 | KDM1A (0.41) | KDM1A | |
| SCHEMBL10535362 | 0.79 | CNR1 (0.37) | OPRM1OPRL1HSD11B1HSD11B2CYP19A1 | |
| SCHEMBL9841692 | 0.78 | KDM1A (0.34) | KDM1AOPRM1 | |
| SCHEMBL9842044 | 0.78 | SCN9A (0.34) | HSD11B1HSD11B2STS | |
| Fluoride SCHEMBL9841326 | 0.78 | STS (0.33) | OPRM1OPRL1HSD11B1HSD11B2CYP19A1 | |
| SCHEMBL9841410 | 0.77 | KDM1A (0.33) | KDM1A | |
| SCHEMBL9841861 | 0.76 | KDM1A (0.33) | KDM1A |
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 |