Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR2 | P50052 | 11/20 | 0.41 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.41 |
| ▸ | KDM1A | O60341 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 2/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.39 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 3/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20170653 | 0.75 | GAA (0.42) | PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL28006262 | 0.69 | GLRA1 (0.42) | AGTR2AGTR1KDM1AMAOAMAOB | |
| SCHEMBL18458090 | 0.67 | GAA (0.44) | AGTR2AGTR1PDE4APDE4BPDE4C | |
| SCHEMBL10073579 | 0.67 | AGTR2 (0.49) | AGTR2AGTR1PDE4APDE4BPDE4C | |
| SCHEMBL9323521 | 0.65 | ALDH1A1 (0.64) | AGTR2AGTR1MAOAMAOBHTR1A | |
| SCHEMBL13301272 | 0.65 | HTR1A (0.34) | HTR1ADRD2 | |
| SCHEMBL21300617 | 0.65 | BCHE (0.67) | HTR1A | |
| SCHEMBL20852458 | 0.65 | NQO2 (0.41) | DRD2 | |
| SCHEMBL2742557 | 0.65 | AGTR2 (0.45) | AGTR2AGTR1MAOAMAOBPDE4B | |
| SCHEMBL20170725 | 0.65 | HTR1A (0.36) | KDM1AMAOAMAOBHTR1ADRD2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2453895-B1 | (+) - MORPHINANS AS ANTAGONISTS OF TOLL-LIKE RECEPTOR 9 AND THERAPEUTIC USES THEREOF | MALLINCKRODT LLC (US) | 2018-05-23 | — | — | EP | disclosed |