Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | GPR6 | P46095 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.37 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.37 |
| ▸ | LTA4H | P09960 | 1/20 | 0.37 |
| ▸ | HRH1 | P35367 | 1/20 | 0.37 |
| ▸ | CCR3 | P51677 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 1/20 | 0.37 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.36 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3959472 | 0.90 | MEN1 (0.46) | MEN1KMT2AEPHX2OPRK1GPR6 | |
| SCHEMBL14715615 | 0.90 | MEN1 (0.46) | MEN1KMT2AEPHX2OPRK1GPR6 | |
| SCHEMBL3963467 | 0.88 | HRH1 (0.43) | OPRK1GPR6DRD2DRD3KCNH2 | |
| SCHEMBL3965016 | 0.86 | FPR2 (0.46) | EPHX2OPRK1HTR2ADRD3KCNH2 | |
| SCHEMBL14715640 | 0.86 | MEN1 (0.43) | MEN1KMT2AEPHX2GPR6DRD2 | |
| SCHEMBL14715616 | 0.86 | MEN1 (0.43) | MEN1KMT2AEPHX2GPR6DRD2 | |
| Hydrochloric Acid SCHEMBL3074655 | 0.85 | MEN1 (0.42) | MEN1KMT2AEPHX2GPR6DRD2 | |
| Hydrochloric Acid SCHEMBL3074657 | 0.85 | MEN1 (0.42) | MEN1KMT2AEPHX2GPR6DRD2 | |
| SCHEMBL3968789 | 0.84 | DRD2 (0.41) | EPHX2OPRK1DRD2DRD3HRH1 | |
| SCHEMBL3078175 | 0.83 | DRD2 (0.56) | DRD2HTR2ADRD3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2079693-B1 | ETHER DERIVATIVES DUAL MODULATORS OF THE 5-HT2A AND D3 RECEPTORS | HOFFMANN LA ROCHE (CH) | 2013-02-27 | — | — | EP | claimed |
| EP-2079693-A1 | ETHER DERIVATIVES DUAL MODULATORS OF THE 5-HT2A AND D3 RECEPTORS | F. Hoffmann-Roche AG (CH) | 2009-07-22 | — | — | EP | claimed |
| WO-2008052899-A1 | ETHER DERIVATIVES DUAL MODULATORS OF THE 5-HT2A AND D3 RECEPTORS | F. HOFFMANN-LA ROCHE AG (CH) | 2008-05-08 | — | — | WO | claimed |
| EP-2079693-B1 | ETHER DERIVATIVES DUAL MODULATORS OF THE 5-HT2A AND D3 RECEPTORS | HOFFMANN LA ROCHE (CH) | 2013-02-27 | — | — | EP | disclosed |