Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 1/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 2/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | VDR | P11473 | 1/20 | 0.40 |
| ▸ | P4HB | P07237 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 2/20 | 0.39 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | CASR | P41180 | 1/20 | 0.38 |
| ▸ | SLC10A1 | Q14973 | 1/20 | 0.38 |
| ▸ | AHR | P35869 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29029215 | 0.78 | SLC6A2 (0.57) | OPRD1SLC6A2SLC6A4SLC6A3SLC10A1 | |
| SCHEMBL10569701 | 0.78 | SLC6A2 (0.57) | OPRD1SLC6A2SLC6A4SLC6A3SLC10A1 | |
| SCHEMBL17842030 | 0.78 | DYRK1A (0.45) | DYRK1ACLK4DRD2VDRP4HB | |
| SCHEMBL30638827 | 0.78 | SLC6A3 (0.64) | DYRK1ACLK4NFE2L2DRD2VDR | |
| SCHEMBL30879872 | 0.78 | DYRK1A (0.45) | DYRK1ACLK4DRD2VDRP4HB | |
| SCHEMBL29518433 | 0.78 | DYRK1A (0.45) | DYRK1ACLK4NFE2L2DRD2VDR | |
| SCHEMBL28557150 | 0.78 | SLC6A3 (0.64) | DYRK1ACLK4NFE2L2DRD2VDR | |
| SCHEMBL17842130 | 0.78 | DYRK1A (0.45) | DYRK1ACLK4NFE2L2DRD2VDR | |
| Hydrochloric Acid SCHEMBL17842300 | 0.77 | ROCK1 (0.44) | DYRK1ACLK4DRD2VDRP4HB | |
| SCHEMBL29588451 | 0.77 | DYRK1A (0.44) | DYRK1ACLK4NFE2L2DRD2VDR |
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-2016100823-A1 | DOPAMINE D2 RECEPTOR LIGANDS | THE BROAD INSTITUTE, INC. (US) | 2016-06-23 | — | — | WO | disclosed |