Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.45 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.43 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.43 |
| ▸ | KDM1A | O60341 | 2/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 2/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 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 | |
|---|---|---|---|---|
| SCHEMBL8963196 | 1.00 | DRD2 (0.45) | DRD2NPBWR1MCHR1KDM1AMAOA | |
| SCHEMBL8963003 | 0.95 | DRD2 (0.42) | DRD2NPBWR1MCHR1KDM1AMAOA | |
| SCHEMBL8963326 | 0.95 | DRD2 (0.42) | DRD2NPBWR1MCHR1KDM1AMAOA | |
| SCHEMBL8962995 | 0.95 | DRD2 (0.42) | DRD2NPBWR1MCHR1KDM1AMAOA | |
| SCHEMBL8963134 | 0.91 | DRD2 (0.43) | DRD2NPBWR1MCHR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL8963125 | 0.91 | DRD2 (0.43) | DRD2NPBWR1MCHR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL8963019 | 0.86 | HDAC2 (0.45) | MAOAMAOBHTR2CHDAC2 | |
| SCHEMBL8963014 | 0.86 | HDAC2 (0.45) | MAOAMAOBHTR2CHDAC2 | |
| SCHEMBL15274898 | 0.85 | DRD2 (0.46) | DRD2NPBWR1MCHR1KDM1AMAOA | |
| SCHEMBL9450903 | 0.84 | SPHK1 (0.52) | DRD2 |
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-0559860-B1 | HALOVINYL-DERIVATIVES | HOFFMANN LA ROCHE (CH) | 1996-02-14 | — | — | EP | disclosed |
| US-5364556-A | Halovinyl-derivatives | HOFFMANN-LA ROCHE INC. (US) | 1994-11-15 | — | — | US | disclosed |