Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 14/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.39 |
| ▸ | JAK1 | P23458 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 2/20 | 0.39 |
| ▸ | DRD2 | P14416 | 2/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | CASP1 | P29466 | 3/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.36 |
| ▸ | CASP7 | P55210 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | OGFRL1 | Q5TC84 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2274745 | 0.87 | JAK2 (0.53) | HTR6JAK2JAK1DRD3DRD2 | |
| SCHEMBL10281484 | 0.87 | HTR6 (0.42) | HTR6JAK2JAK1DRD3DRD2 | |
| SCHEMBL9953229 | 0.84 | HTR6 (0.45) | HTR6OPRM1OPRD1OPRK1OGFRL1 | |
| SCHEMBL9952745 | 0.83 | JAK1 (0.46) | JAK2JAK1 | |
| SCHEMBL2225763 | 0.83 | HTR6 (0.43) | HTR6JAK2JAK1DRD3DRD2 | |
| SCHEMBL2224738 | 0.82 | JAK1 (0.46) | HTR6JAK2JAK1DRD3DRD2 | |
| SCHEMBL2225758 | 0.81 | HTR6 (0.42) | HTR6JAK2JAK1DRD3DRD2 | |
| SCHEMBL9953719 | 0.81 | OGFRL1 (0.42) | HTR6JAK2JAK1DRD3DRD2 | |
| SCHEMBL2225338 | 0.80 | JAK1 (0.54) | HTR6JAK2JAK1 | |
| SCHEMBL9953377 | 0.79 | JAK2 (0.42) | HTR6JAK2DRD3DRD2MAOB |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012085176-A1 | TRICYCLIC PYRAZINONE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF AS JANUS KINASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2012-06-28 | — | — | WO | disclosed |