Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 3/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.37 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 3/20 | 0.33 |
| ▸ | PGR | P06401 | 3/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL8972500 | 1.00 | AHR (0.39) | AHRSLC6A3CYP1B1MAOBPGR | |
| SCHEMBL9312292 | 1.00 | AHR (0.39) | AHRSLC6A3CYP1B1MAOBPGR | |
| SCHEMBL8972495 | 1.00 | AHR (0.39) | AHRSLC6A3CYP1B1MAOBPGR | |
| SCHEMBL9311904 | 0.88 | FFAR1 (0.32) | SLC6A3PGRSLC6A2SLC6A4 | |
| SCHEMBL9311912 | 0.88 | FFAR1 (0.32) | SLC6A3PGRSLC6A2SLC6A4 | |
| SCHEMBL8972309 | 0.88 | FFAR1 (0.32) | SLC6A3PGRSLC6A2SLC6A4 | |
| SCHEMBL8972300 | 0.88 | FFAR1 (0.32) | SLC6A3PGRSLC6A2SLC6A4 | |
| SCHEMBL9313076 | 0.85 | MAPK1 (0.40) | MAOBTAAR1MAPK1NPSR1 | |
| SCHEMBL8972046 | 0.85 | MAPK1 (0.40) | MAOBTAAR1MAPK1NPSR1 | |
| SCHEMBL8972052 | 0.85 | MAPK1 (0.40) | MAOBTAAR1MAPK1NPSR1 |
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-5322638-A | Halophenyl substituted dioxanes | HOFFMANN-LA ROCHE INC. (US) | 1994-06-21 | — | — | US | disclosed |