Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 4/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | CCR3 | P51677 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL17285906 | 0.87 | ACHE (0.57) | DRD3KCNH2POLBCYP2D6CYP2C9 | |
| SCHEMBL22878313 | 0.87 | DRD3 (0.54) | DRD3KCNH2POLBCYP2D6CYP2C9 | |
| SCHEMBL18876620 | 0.85 | KCNH2 (0.52) | DRD3KCNH2POLBCYP2D6CYP2C9 | |
| SCHEMBL17281928 | 0.84 | DRD3 (0.51) | DRD3KCNH2POLBCYP2D6CYP2C9 | |
| SCHEMBL4873038 | 0.79 | DRD3 (0.60) | DRD3KCNH2POLBCYP2D6CYP2C9 | |
| SCHEMBL29450073 | 0.76 | KMT2A (0.76) | DRD3KCNH2POLBCYP2D6CYP2C9 | |
| SCHEMBL16416392 | 0.76 | KMT2A (0.76) | DRD3KCNH2POLBCYP2D6CYP2C9 | |
| SCHEMBL17284644 | 0.76 | GNAI3 (0.47) | DRD3KCNH2KMT2ADRD2MAPK1 | |
| SCHEMBL1587336 | 0.75 | SIGMAR1 (0.70) | KCNH2POLBCYP2D6CYP2C19KMT2A | |
| SCHEMBL42207 | 0.75 | ACHE (0.67) | DRD3DRD2SIGMAR1CCR3 |
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-2015177326-A1 | 5-CHLORO-2-DIFLUOROMETHOXYPHENYL PYRAZOLOPYRIMIDINE COMPOUNDS WHICH ARE JAK INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2015-11-26 | — | — | WO | disclosed |