Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 10/20 | 0.73 |
| ▸ | SLC6A3 | Q01959 | 10/20 | 0.73 |
| ▸ | HTR1A | P08908 | 7/20 | 0.73 |
| ▸ | DRD2 | P14416 | 7/20 | 0.73 |
| ▸ | DRD4 | P21917 | 7/20 | 0.73 |
| ▸ | HTR2A | P28223 | 7/20 | 0.73 |
| ▸ | HTR2C | P28335 | 7/20 | 0.73 |
| ▸ | HTR7 | P34969 | 7/20 | 0.73 |
| ▸ | OPRK1 | P41145 | 7/20 | 0.73 |
| ▸ | HTR1D | P28221 | 6/20 | 0.73 |
| ▸ | HRH2 | P25021 | 6/20 | 0.73 |
| ▸ | DRD3 | P35462 | 6/20 | 0.73 |
| ▸ | HTR2B | P41595 | 6/20 | 0.73 |
| ▸ | DRD1 | P21728 | 5/20 | 0.73 |
| ▸ | DRD5 | P21918 | 5/20 | 0.73 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.73 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.73 |
| ▸ | OPRD1 | P41143 | 5/20 | 0.73 |
| ▸ | HTR6 | P50406 | 5/20 | 0.73 |
| ▸ | HRH1 | P35367 | 4/20 | 0.73 |
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 | |
|---|---|---|---|---|
| SCHEMBL904909 | 0.87 | CYP3A4 (0.57) | OPRM1SLC6A3HTR1ADRD2DRD4 | |
| SCHEMBL904880 | 0.86 | TACR3 (0.54) | OPRM1SLC6A3HTR1ADRD2DRD4 | |
| SCHEMBL904871 | 0.86 | DRD2 (0.58) | OPRM1SLC6A3HTR1ADRD2DRD4 | |
| SCHEMBL904887 | 0.85 | OPRM1 (0.71) | OPRM1SLC6A3HTR1ADRD2DRD4 | |
| Penfluridol SCHEMBL93939 | 0.84 | OPRM1 (1.00) | OPRM1SLC6A3HTR1ADRD2DRD4 | |
| Penfluridol SCHEMBL30546621 | 0.84 | OPRM1 (1.00) | OPRM1SLC6A3HTR1ADRD2DRD4 | |
| SCHEMBL904874 | 0.84 | TACR3 (0.57) | OPRM1SLC6A3HTR1ADRD2DRD4 | |
| Penfluridol SCHEMBL28123335 | 0.84 | OPRM1 (0.94) | OPRM1SLC6A3HTR1ADRD2DRD4 | |
| SCHEMBL904873 | 0.83 | DRD2 (0.54) | OPRM1SLC6A3HTR1ADRD2DRD4 | |
| SCHEMBL904872 | 0.83 | CYP3A4 (0.55) | OPRM1SLC6A3HTR1ADRD2DRD4 |
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-2011143444-A2 | DIPHENYLBUTYPIPERIDINE AUTOPHAGY INDUCERS | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2011-11-17 | — | — | WO | disclosed |