Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 17/20 | 0.65 |
| ▸ | PGR | P06401 | 4/20 | 0.55 |
| ▸ | AR | P10275 | 4/20 | 0.55 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.55 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.55 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.50 |
| ▸ | CNR1 | P21554 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL20691865 | 1.00 | NR3C1 (0.65) | NR3C1PGRARADORA3NR3C2 | |
| SCHEMBL19201314 | 0.99 | NR3C1 (0.65) | NR3C1PGRARADORA3NR3C2 | |
| SCHEMBL22911477 | 0.89 | NR3C1 (0.65) | NR3C1PGRARADORA3NR3C2 | |
| SCHEMBL19201309 | 0.89 | NR3C1 (0.76) | NR3C1PGRARADORA3NR3C2 | |
| SCHEMBL18736583 | 0.87 | NR3C1 (0.55) | NR3C1PGRARADORA3NR3C2 | |
| SCHEMBL19026496 | 0.86 | NR3C1 (0.55) | NR3C1PGRARADORA3NR3C2 | |
| SCHEMBL19026494 | 0.86 | NR3C1 (0.55) | NR3C1PGRARADORA3NR3C2 | |
| SCHEMBL19201562 | 0.85 | NR3C1 (0.58) | NR3C1PGRARADORA3NR3C2 | |
| SCHEMBL20691884 | 0.84 | NR3C1 (0.65) | NR3C1PGRARADORA3NR3C2 | |
| SCHEMBL19201317 | 0.83 | NR3C1 (0.64) | NR3C1PGRARADORA3NR3C2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017132103-A2 | PHOSPHONATE LINKERS AND THEIR USE TO FACILITATE CELLULAR RETENTION OF COMPOUNDS | MERCK SHARP & DOHME CORP. (US) | 2017-08-03 | — | — | WO | disclosed |