Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK1 | P23458 | 6/20 | 0.39 |
| ▸ | HTR6 | P50406 | 9/20 | 0.34 |
| ▸ | JAK2 | O60674 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | TYK2 | P29597 | 1/20 | 0.31 |
| ▸ | JAK3 | P52333 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR7 | P34969 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.30 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.30 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2224979 | 0.88 | JAK1 (0.46) | JAK1JAK2ALDH1A1TYK2JAK3 | |
| SCHEMBL2282738 | 0.86 | JAK1 (0.37) | JAK1HTR6JAK2TYK2JAK3 | |
| SCHEMBL2273331 | 0.83 | JAK1 (0.39) | JAK1HTR6JAK2KDM4EALDH1A1 | |
| SCHEMBL2273996 | 0.82 | JAK1 (0.41) | JAK1JAK2TYK2JAK3 | |
| SCHEMBL2274748 | 0.80 | JAK2 (0.53) | JAK1HTR6JAK2TYK2JAK3 | |
| SCHEMBL2365117 | 0.76 | JAK2 (0.42) | JAK1JAK2TYK2JAK3 | |
| SCHEMBL2279205 | 0.75 | JAK1 (0.43) | JAK1JAK2ALDH1A1TYK2JAK3 | |
| SCHEMBL2280645 | 0.74 | JAK1 (0.53) | JAK1JAK2KDM4EALDH1A1MAPT | |
| SCHEMBL2277351 | 0.74 | JAK1 (0.53) | JAK1JAK2TYK2JAK3 | |
| SCHEMBL2227229 | 0.73 | JAK1 (0.45) | JAK1JAK2KDM4EALDH1A1TYK2 |
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 |