Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 20/20 | 0.54 |
| ▸ | NR3C2 | P08235 | 10/20 | 0.47 |
| ▸ | PGR | P06401 | 9/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL379407 | 0.89 | NR3C1 (0.61) | NR3C1NR3C2PGRCYP3A4KCNH2 | |
| SCHEMBL379408 | 0.89 | NR3C1 (0.61) | NR3C1NR3C2PGRCYP3A4KCNH2 | |
| SCHEMBL379397 | 0.86 | NR3C1 (0.47) | NR3C1NR3C2PGRCYP3A4 | |
| SCHEMBL13623771 | 0.85 | NR3C1 (0.51) | NR3C1NR3C2PGRCYP3A4 | |
| SCHEMBL5642724 | 0.78 | NR3C1 (0.45) | NR3C1NR3C2PGRCYP3A4 | |
| SCHEMBL379422 | 0.78 | NR3C1 (0.58) | NR3C1NR3C2PGRCYP3A4 | |
| SCHEMBL379423 | 0.78 | NR3C1 (0.58) | NR3C1NR3C2PGRCYP3A4 | |
| SCHEMBL12122089 | 0.75 | NR3C1 (0.61) | NR3C1NR3C2PGRCYP3A4 | |
| SCHEMBL379406 | 0.75 | NR3C1 (0.48) | NR3C1NR3C2PGRCYP3A4 | |
| SCHEMBL5643833 | 0.74 | FFAR1 (0.43) | NR3C1NR3C2PGRCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2280974-B1 | STEREOSELECTIVE SYNTHESIS OF CERTAIN TRIFLUOROMETHYL-SUBSTITUTED ALCOHOLS | BOEHRINGER INGELHEIM INT (DE) | 2012-01-25 | — | — | EP | disclosed |