Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 17/20 | 0.86 |
| ▸ | PGR | P06401 | 4/20 | 0.82 |
| ▸ | AR | P10275 | 4/20 | 0.82 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.82 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.82 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.82 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.82 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.72 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.72 |
| ▸ | CNR1 | P21554 | 1/20 | 0.63 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.63 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL20679045 | 0.94 | NR3C1 (0.83) | NR3C1PGRARADORA3NR3C2 | |
| SCHEMBL19201306 | 0.92 | NR3C1 (1.00) | NR3C1PGRARADORA3NR3C2 | |
| SCHEMBL19201588 | 0.92 | NR3C1 (1.00) | NR3C1PGRARADORA3NR3C2 | |
| SCHEMBL26964859 | 0.92 | NR3C1 (1.00) | NR3C1PGRARADORA3NR3C2 | |
| SCHEMBL13950976 | 0.92 | NR3C1 (0.86) | NR3C1PGRARADORA3NR3C2 | |
| SCHEMBL14421353 | 0.92 | NR3C1 (0.86) | NR3C1PGRARADORA3NR3C2 | |
| SCHEMBL13951204 | 0.92 | NR3C1 (0.88) | NR3C1PGRARADORA3NR3C2 | |
| SCHEMBL20679014 | 0.92 | NR3C1 (0.91) | NR3C1PGRARADORA3NR3C2 | |
| SCHEMBL13950966 | 0.92 | NR3C1 (0.78) | NR3C1PGRARADORA3NR3C2 | |
| SCHEMBL19201589 | 0.92 | NR3C1 (1.00) | 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 |