Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 5/20 | 0.49 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.44 |
| ▸ | PGR | P06401 | 3/20 | 0.43 |
| ▸ | SLC22A12 | Q96S37 | 4/20 | 0.41 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.38 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.38 |
| ▸ | SLC22A11 | Q9NSA0 | 1/20 | 0.38 |
| ▸ | ESRRA | P11474 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL479812 | 0.86 | HTR2A (0.47) | PGRHTR2AKCNH2 | |
| SCHEMBL474037 | 0.79 | AR (0.52) | ARMRGPRX4PGRSLC22A12PLA2G7 | |
| SCHEMBL474054 | 0.79 | AR (0.51) | ARMRGPRX4PGRSLC22A12HTR2A | |
| SCHEMBL8071507 | 0.78 | AR (0.54) | ARMRGPRX4PGR | |
| SCHEMBL30557829 | 0.76 | CYP3A4 (0.47) | MRGPRX4HTR2AKCNH2 | |
| SCHEMBL17767019 | 0.76 | CYP3A4 (0.47) | MRGPRX4HTR2AKCNH2 | |
| SCHEMBL30338514 | 0.75 | P2RX7 (0.47) | ARMRGPRX4PGRHTR2AKCNH2 | |
| SCHEMBL13172498 | 0.75 | ADRA1D (0.45) | ARMRGPRX4 | |
| SCHEMBL19972837 | 0.75 | P2RX7 (0.47) | ARMRGPRX4PGRHTR2AKCNH2 | |
| SCHEMBL474005 | 0.73 | AR (0.68) | ARPGRSLC22A12HTR2AKCNH2 |
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-2411365-A1 | 2,3-DIARYL- OR HETEROARYL-SUBSTITUTED 1,1,1-TRIFLUORO-2-HYDROXYPROPYL COMPOUNDS | F. Hoffmann-La Roche AG (CH) | 2012-02-01 | — | — | EP | disclosed |
| WO-2010108903-A1 | 2,3-DIARYL- OR HETEROARYL-SUBSTITUTED 1,1,1-TRIFLUORO-2-HYDROXYPROPYL COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-09-30 | — | — | WO | disclosed |