Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FYN | P06241 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | FNTA | P49354 | 1/20 | 0.39 |
| ▸ | FNTB | P49356 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 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 | |
|---|---|---|---|---|
| SCHEMBL7456278 | 0.86 | DRD3 (0.50) | FYNHTR1ADRD3ALDH1A1CYP2D6 | |
| SCHEMBL7457771 | 0.85 | FNTA (0.40) | FYNHTR1ADRD3ALDH1A1CYP2D6 | |
| SCHEMBL7451624 | 0.85 | FYN (0.45) | FYNHTR1ADRD3ALDH1A1CYP2D6 | |
| SCHEMBL8103965 | 0.85 | ALDH1A1 (0.55) | FYNHTR1ADRD3ALDH1A1CYP2D6 | |
| SCHEMBL7453175 | 0.84 | FYN (0.44) | FYNHTR1ADRD3ALDH1A1CYP2D6 | |
| SCHEMBL7451238 | 0.83 | DRD2 (0.51) | DRD3ALDH1A1CYP2D6CYP2C9ALOX15 | |
| SCHEMBL7443295 | 0.83 | FYN (0.45) | FYNHTR1ADRD3ALDH1A1CYP2D6 | |
| SCHEMBL7456265 | 0.81 | DRD3 (0.54) | FYNHTR1ADRD3ALDH1A1CYP2D6 | |
| SCHEMBL7456004 | 0.81 | CA1 (0.56) | FYNHTR1ADRD3 | |
| SCHEMBL8103977 | 0.80 | FYN (0.55) | FYNHTR1ADRD3ALDH1A1CYP2D6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6084130-A | FOR TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS | PHARMACIA & UPJOHN COMPANY (US) | 2000-07-04 | — | — | US | disclosed |
| EP-0923542-A1 | ARYL SUBSTITUTED CYCLIC AMINES AS SELECTIVE DOPAMINE D3 LIGANDS | PHARMACIA & UPJOHN COMPANY (US) | 1999-06-23 | — | — | EP | disclosed |
| WO-1997045403-A1 | ARYL SUBSTITUTED CYCLIC AMINES AS SELECTIVE DOPAMINE D3 LIGANDS | PHARMACIA & UPJOHN COMPANY (US) | 1997-12-04 | — | — | WO | disclosed |