Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 19/20 | 0.43 |
| ▸ | NR3C2 | P08235 | 11/20 | 0.43 |
| ▸ | PGR | P06401 | 8/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3649794 | 0.84 | CHRM3 (0.37) | NR3C1NR3C2PGRCYP3A4CHRM3 | |
| SCHEMBL3649792 | 0.81 | NR3C1 (0.45) | NR3C1NR3C2PGRCYP3A4CHRM3 | |
| SCHEMBL5800422 | 0.81 | NR3C1 (0.52) | NR3C1NR3C2PGR | |
| SCHEMBL5814173 | 0.74 | NR3C1 (0.36) | NR3C1NR3C2PGRCYP3A4CHRM3 | |
| SCHEMBL5815655 | 0.74 | NR3C1 (0.44) | NR3C1NR3C2PGRCYP3A4 | |
| SCHEMBL19068264 | 0.71 | NR3C1 (0.44) | NR3C1NR3C2PGRCYP3A4CHRM3 | |
| SCHEMBL379397 | 0.71 | NR3C1 (0.47) | NR3C1NR3C2PGRCYP3A4CHRM3 | |
| SCHEMBL3812826 | 0.71 | NR3C1 (0.41) | NR3C1NR3C2PGRCYP3A4CHRM3 | |
| SCHEMBL5801445 | 0.71 | NR3C1 (0.44) | NR3C1NR3C2PGRCYP3A4 | |
| SCHEMBL18711606 | 0.70 | NR3C1 (0.44) | NR3C1NR3C2PGRCYP3A4CHRM3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1673088-A1 | 1,1,1- TRIFLUORO-4-PHENYL-4-METHYL-2-(1H-PYRROLO¬2,3-C|PYRIDIN-2-YLMETHYL)PENTAN-2-OL DERIVATIVES AND RELATED COMPOUNDS AS GLUCOCORTICOID LIGANDS FOR THE TREATMENT OF INFLAMMATORY DISEASES AND DIABETES | BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) | 2006-06-28 | — | — | EP | disclosed |
| WO-2005030213-A1 | 1,1,1-TRIFLUORO-4-PHENYL-4-METHYL-2-(1H-PYRROLO | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 2005-04-07 | — | — | WO | disclosed |