Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 7/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 2/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 5/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.39 |
| ▸ | ADRA1B | P35368 | 4/20 | 0.39 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7700603 | 0.82 | OPRM1 (0.52) | OPRM1KCNH2OPRD1OPRK1ADRA1A | |
| SCHEMBL7697015 | 0.79 | KCNH2 (0.42) | OPRM1KCNH2HTR2AHTR2COPRD1 | |
| SCHEMBL7697424 | 0.74 | HTR2A (0.51) | OPRM1HTR2AHTR2CACHE | |
| SCHEMBL7695908 | 0.74 | HTR2A (0.43) | OPRM1KCNH2HTR2AHTR2CADRA1A | |
| SCHEMBL7695892 | 0.73 | HTR2A (0.45) | KCNH2HTR2AHTR2CDRD2ACHE | |
| SCHEMBL7700744 | 0.72 | KCNH2 (0.40) | OPRM1KCNH2HTR2AHTR2CSIGMAR1 | |
| SCHEMBL7694829 | 0.69 | HTR2A (0.46) | KCNH2HTR2AHTR2CSIGMAR1ACHE | |
| SCHEMBL7707462 | 0.68 | ACHE (0.44) | KCNH2HTR2AHTR2CACHE | |
| SCHEMBL7700571 | 0.66 | ACHE (0.42) | KCNH2HTR2AHTR2CDRD2SIGMAR1 | |
| SCHEMBL7698613 | 0.66 | HTR2A (0.39) | OPRM1HTR2AOPRD1OPRK1SIGMAR1 |
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-2002046187-A1 | ANALGESIC DIAZABICYCLO[4.3.0]NONANES | SEPRACOR, INC. (US) | 2002-06-13 | — | — | WO | disclosed |