Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK1 | P23458 | 7/20 | 0.53 |
| ▸ | ACVR1 | Q04771 | 3/20 | 0.37 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.37 |
| ▸ | BMPR1A | P36894 | 1/20 | 0.37 |
| ▸ | ACVR1B | P36896 | 1/20 | 0.37 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 2/20 | 0.36 |
| ▸ | TYK2 | P29597 | 2/20 | 0.36 |
| ▸ | JAK3 | P52333 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | USP5 | P45974 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2280883 | 0.89 | HTT (0.50) | JAK1ALDH1A1SMN1; SMN2HTTCYP2C19 | |
| SCHEMBL2274818 | 0.86 | JAK1 (0.46) | JAK1SMN1; SMN2HTTMAOBHTR6 | |
| SCHEMBL2223730 | 0.85 | JAK1 (0.53) | JAK1JAK2TYK2JAK3CYP2C19 | |
| SCHEMBL2226057 | 0.85 | JAK1 (0.51) | JAK1JAK2TYK2JAK3HTR6 | |
| SCHEMBL2279026 | 0.85 | JAK1 (0.52) | JAK1JAK2TYK2JAK3ALDH1A1 | |
| SCHEMBL2276333 | 0.85 | JAK1 (0.52) | JAK1JAK2TYK2JAK3HTR6 | |
| SCHEMBL2273246 | 0.84 | JAK1 (0.52) | JAK1JAK2TYK2JAK3CYP2C19 | |
| SCHEMBL2223327 | 0.84 | JAK1 (0.53) | JAK1JAK2TYK2JAK3MAOB | |
| SCHEMBL2283215 | 0.83 | JAK1 (0.46) | JAK1JAK2TYK2JAK3HTR6 | |
| SCHEMBL2270971 | 0.83 | JAK1 (0.48) | JAK1JAK2TYK2JAK3HTR6 |
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 |