Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 2/20 | 0.35 |
| ▸ | JAK3 | P52333 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | JAK1 | P23458 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | SCN1A | P35498 | 1/20 | 0.34 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | HTR6 | P50406 | 2/20 | 0.34 |
| ▸ | DRD4 | P21917 | 2/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3330713 | 0.83 | CYP3A4 (0.49) | CYP3A4MAOAACHEMAOBCNR2 | |
| SCHEMBL3327197 | 0.82 | CYP3A4 (0.49) | CYP3A4MAOAACHEMAOBCNR2 | |
| SCHEMBL3631945 | 0.78 | SLC6A2 (0.51) | MAOBSLC6A2SLC6A4HTR6DCUN1D1 | |
| SCHEMBL3633857 | 0.78 | SLC6A2 (0.43) | JAK3SLC6A2SLC6A4JAK2JAK1 | |
| SCHEMBL3392769 | 0.77 | CYP3A4 (0.48) | CYP3A4MAOAACHEMAOBCNR2 | |
| SCHEMBL13319140 | 0.73 | DRD4 (0.41) | CYP3A4JAK3JAK2JAK1DRD4 | |
| SCHEMBL3634073 | 0.73 | TACR1 (0.44) | MAOBSLC6A2SLC6A4TACR1 | |
| SCHEMBL3325286 | 0.72 | CYP3A4 (0.47) | CYP3A4JAK3JAK2CHRM4 | |
| SCHEMBL3633393 | 0.70 | SLC6A2 (0.43) | JAK3SLC6A2SLC6A4JAK2JAK1 | |
| SCHEMBL3972380 | 0.68 | SLC6A2 (0.39) | MAOBJAK3SLC6A2SLC6A4JAK2 |
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-2148872-A1 | PYRIDINE DERIVATIVES AS FAST DISSOCIATING DOPAMINE 2 RECEPTOR ANTAGONISTS | Janssen Pharmaceutica, N.V. (BE) | 2010-02-03 | — | — | EP | claimed |
| WO-2008128994-A1 | PYRIDINE DERIVATIVES AS FAST DISSOCIATING DOPAMINE 2 RECEPTOR ANTAGONISTS | JANSSEN PHARMACEUTICA N.V. (BE) | 2008-10-30 | — | — | WO | claimed |