Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR119 | Q8TDV5 | 6/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.35 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.35 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.35 |
| ▸ | TEAD1 | P28347 | 1/20 | 0.35 |
| ▸ | TEAD3 | Q99594 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 2/20 | 0.34 |
| ▸ | RORC | P51449 | 1/20 | 0.34 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22310514 | 0.91 | GPR119 (0.41) | GPR119CYP2C9CYP2C19HTR2BMAPK14 | |
| SCHEMBL20060881 | 0.87 | GPR119 (0.38) | GPR119MAOB | |
| SCHEMBL20061055 | 0.85 | GPR119 (0.47) | GPR119THRBMAOB | |
| SCHEMBL20060927 | 0.85 | GPR119 (0.47) | GPR119THRBMAOB | |
| SCHEMBL20060844 | 0.85 | GPR119 (0.46) | GPR119 | |
| SCHEMBL20060919 | 0.85 | HCRTR1 (0.42) | GPR119 | |
| SCHEMBL22311335 | 0.84 | NR1H2 (0.46) | GPR119CYP2C9CYP2C19HTR2BMAPK14 | |
| SCHEMBL22311336 | 0.84 | NR1H2 (0.46) | GPR119CYP2C9CYP2C19HTR2BMAPK14 | |
| SCHEMBL30451610 | 0.84 | NR1H2 (0.46) | GPR119CYP2C9CYP2C19HTR2BMAPK14 | |
| SCHEMBL20060882 | 0.82 | GPR119 (0.39) | GPR119NAMPTTHRB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018071317-A1 | ARYL AND HETEROARYL ETHER DERIVATIVES AS LIVER X RECEPTOR BETA AGONISTS | MERCK SHARP & DOHME CORP. (US) | 2018-04-19 | — | — | WO | disclosed |
| WO-2018068295-A1 | ARYL AND HETEROARYL ETHER DERIVATIVES AS LIVER X RECEPTOR β AGONISTS, COMPOSITIONS, AND THEIR USE | MERCK SHARP & DOHME CORP. (US) | 2018-04-19 | — | — | WO | disclosed |