Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 1/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.31 |
| ▸ | PGR | P06401 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.30 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 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 | |
|---|---|---|---|---|
| SCHEMBL9311912 | 1.00 | FFAR1 (0.32) | FFAR1GRM2CYP11B1CYP11B2PGR | |
| SCHEMBL8972300 | 1.00 | FFAR1 (0.32) | FFAR1GRM2CYP11B1CYP11B2PGR | |
| SCHEMBL9311904 | 1.00 | FFAR1 (0.32) | FFAR1GRM2CYP11B1CYP11B2PGR | |
| SCHEMBL8972495 | 0.88 | AHR (0.39) | PGRSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL9312292 | 0.88 | AHR (0.39) | PGRSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8972500 | 0.88 | AHR (0.39) | PGRSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL9312294 | 0.88 | AHR (0.39) | PGRSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8972512 | 0.88 | CYP11B2 (0.33) | CYP11B1CYP11B2PGR | |
| SCHEMBL9312429 | 0.88 | CYP11B2 (0.33) | CYP11B1CYP11B2PGR | |
| SCHEMBL9312426 | 0.88 | CYP11B2 (0.33) | CYP11B1CYP11B2PGR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0433836-B1 | Halophenyl substituted dioxanes | HOFFMANN LA ROCHE (CH) | 1996-03-27 | — | — | EP | disclosed |
| US-5322638-A | Halophenyl substituted dioxanes | HOFFMANN-LA ROCHE INC. (US) | 1994-06-21 | — | — | US | disclosed |
| EP-0433836-A2 | Halophenyl substituted dioxanes | F. HOFFMANN-LA ROCHE AG (CH) | 1991-06-26 | — | — | EP | disclosed |