Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHIA | Q9BZP6 | 4/20 | 0.58 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.53 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.52 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.48 |
| ▸ | HRH1 | P35367 | 1/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.48 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | CHIT1 | Q13231 | 3/20 | 0.45 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.44 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.44 |
| ▸ | HRH2 | P25021 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL17284447 | 0.91 | SLC6A2 (0.58) | CHIAGRIN2BSIGMAR1SLC18A3SLC6A2 | |
| SCHEMBL2056178 | 0.86 | GRIN2B (0.58) | CHIAGRIN2BSIGMAR1SLC18A3CYP2D6 | |
| SCHEMBL17284585 | 0.85 | CHIA (0.46) | CHIAGRIN2BSIGMAR1CYP2D6CHRM1 | |
| SCHEMBL17284552 | 0.85 | CHIA (0.60) | CHIASIGMAR1AOC3CHIT1 | |
| SCHEMBL1967143 | 0.85 | GRIN2B (0.63) | CHIAGRIN2BSIGMAR1SLC18A3AOC3 | |
| SCHEMBL22878119 | 0.84 | CHIA (0.55) | CHIAGRIN2BSIGMAR1SLC18A3CYP2D6 | |
| SCHEMBL17284204 | 0.84 | GRIN2B (0.51) | GRIN2BSIGMAR1SLC18A3CYP2D6CHRM1 | |
| SCHEMBL7471631 | 0.83 | OPRM1 (0.62) | CHIAGRIN2BSIGMAR1CYP2D6CHRM1 | |
| SCHEMBL17284559 | 0.82 | AOC3 (0.53) | CHIASIGMAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL17284596 | 0.82 | CHIA (0.50) | CHIASIGMAR1CYP2D6CHRM1HRH1 |
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 |