Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 20/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 13/20 | 0.61 |
| ▸ | NR3C2 | P08235 | 6/20 | 0.43 |
| ▸ | PGR | P06401 | 6/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3748995 | 0.91 | NR3C1 (0.69) | NR3C1CYP3A4NR3C2PGRKCNH2 | |
| SCHEMBL3755290 | 0.83 | NR3C1 (0.54) | NR3C1CYP3A4NR3C2PGR | |
| SCHEMBL5798004 | 0.82 | NR3C1 (0.84) | NR3C1CYP3A4NR3C2PGRKCNH2 | |
| SCHEMBL4555711 | 0.80 | NR3C1 (0.54) | NR3C1CYP3A4NR3C2PGRKCNH2 | |
| SCHEMBL676013 | 0.80 | NR3C1 (0.53) | NR3C1CYP3A4NR3C2PGR | |
| SCHEMBL5799170 | 0.77 | NR3C1 (0.50) | NR3C1CYP3A4NR3C2PGR | |
| SCHEMBL3743370 | 0.77 | NR3C1 (0.53) | NR3C1CYP3A4NR3C2PGR | |
| SCHEMBL3752990 | 0.76 | NR3C1 (0.49) | NR3C1CYP3A4NR3C2PGRKCNH2 | |
| SCHEMBL3710020 | 0.76 | NR3C1 (0.52) | NR3C1CYP3A4NR3C2PGR | |
| SCHEMBL292321 | 0.76 | NR3C1 (1.00) | NR3C1CYP3A4NR3C2PGRKCNH2 |
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 |