Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | PPARD | Q03181 | 12/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 5/20 | 0.34 |
| ▸ | PPARG | P37231 | 3/20 | 0.34 |
| ▸ | PPARA | Q07869 | 2/20 | 0.34 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.33 |
| ▸ | THRA | P10827 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL479674 | 0.92 | PPOX (0.33) | THRATHRBCYP2C19 | |
| SCHEMBL479958 | 0.91 | MCL1 (0.41) | MCL1PPARDFFAR1PPARGPPARA | |
| SCHEMBL480020 | 0.84 | PRKAB2 (0.33) | PPARDPPARGPPARA | |
| SCHEMBL479852 | 0.84 | SMN1; SMN2 (0.40) | PPARDFFAR1PPARGPPARATHRA | |
| SCHEMBL480101 | 0.84 | MCL1 (0.35) | MCL1FFAR1THRATHRB | |
| SCHEMBL479931 | 0.83 | S1PR2 (0.33) | PPARDPPARGPPARATHRATHRB | |
| SCHEMBL732947 | 0.83 | CYP2C19 (0.35) | PPARDFFAR1PPARGPPARANR3C1 | |
| SCHEMBL753291 | 0.83 | CYP2C19 (0.35) | PPARDFFAR1PPARGPPARANR3C1 | |
| SCHEMBL479912 | 0.83 | THRB (0.35) | THRATHRB | |
| SCHEMBL480172 | 0.82 | NR3C1 (0.34) | MCL1PPARDFFAR1PPARGPPARA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2411361-A1 | 1,1,1-TRIFLUORO-2-HYDROXYPROPYL COMPOUNDS | F. Hoffmann-La Roche AG (CH) | 2012-02-01 | — | — | EP | claimed |
| WO-2010108902-A1 | 1,1,1-TRIFLUORO-2-HYDROXYPROPYL COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-09-30 | — | — | WO | claimed |
| EP-2411361-A1 | 1,1,1-TRIFLUORO-2-HYDROXYPROPYL COMPOUNDS | F. Hoffmann-La Roche AG (CH) | 2012-02-01 | — | — | EP | disclosed |
| WO-2010108902-A1 | 1,1,1-TRIFLUORO-2-HYDROXYPROPYL COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-09-30 | — | — | WO | disclosed |