Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK1 | P23458 | 2/20 | 0.39 |
| ▸ | JAK2 | O60674 | 1/20 | 0.39 |
| ▸ | TYK2 | P29597 | 1/20 | 0.39 |
| ▸ | JAK3 | P52333 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 8/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2224673 | 0.87 | HTR6 (0.43) | HTR6CYP2C19HTR1ADRD2HTR2A | |
| SCHEMBL2279203 | 0.87 | JAK1 (0.36) | JAK1JAK2TYK2JAK3HTR6 | |
| SCHEMBL2226408 | 0.83 | HTR6 (0.42) | HTR6OPRD1OPRK1 | |
| SCHEMBL14605122 | 0.80 | JAK1 (0.45) | JAK1JAK2TYK2JAK3CYP2C19 | |
| SCHEMBL2276970 | 0.74 | JAK1 (0.50) | JAK1JAK2TYK2JAK3HTR6 | |
| SCHEMBL2282730 | 0.74 | HTR6 (0.40) | HTR6CYP2C19HTR1ADRD2HTR2A | |
| SCHEMBL2280338 | 0.74 | JAK1 (0.68) | JAK1JAK2TYK2JAK3ALDH1A1 | |
| SCHEMBL2365115 | 0.73 | HTT (0.41) | JAK1JAK2TYK2JAK3HTR6 | |
| SCHEMBL14644680 | 0.73 | JAK1 (0.44) | JAK1JAK2TYK2JAK3CYP2C19 | |
| SCHEMBL2280478 | 0.72 | HTR6 (0.41) | HTR6OPRD1OPRK1ALOX15TSHR |
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-2523957-A1 | TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF | F. Hoffmann-La Roche AG (CH) | 2012-11-21 | — | — | EP | disclosed |
| WO-2011086053-A1 | TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF | F. HOFFMANN-LA ROCHE AG (CH) | 2011-07-21 | — | — | WO | disclosed |