Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | HRH2 | P25021 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7694829 | 0.78 | HTR2A (0.46) | HTR2AMEN1KMT2AKCNH2ACHE | |
| SCHEMBL7698617 | 0.76 | HTR2A (0.41) | HTR2AOPRM1OPRK1CHRM3ADRA1A | |
| SCHEMBL7698613 | 0.75 | HTR2A (0.39) | HTR2AOPRM1OPRK1MEN1KMT2A | |
| SCHEMBL7698615 | 0.75 | LTA4H (0.48) | HTR2AMEN1KMT2AACHESIGMAR1 | |
| SCHEMBL7707462 | 0.74 | ACHE (0.44) | HTR2AKCNH2ACHEBCHE | |
| SCHEMBL7695892 | 0.73 | HTR2A (0.45) | HTR2AMEN1KMT2ADRD2KCNH2 | |
| SCHEMBL7700571 | 0.72 | ACHE (0.42) | HTR2ADRD2SLC6A4HTR2BKCNH2 | |
| SCHEMBL7695908 | 0.72 | HTR2A (0.43) | HTR2AOPRM1ADRA1AMEN1KMT2A | |
| SCHEMBL7705775 | 0.71 | KDM4E (0.49) | ACHEBCHE | |
| SCHEMBL7697015 | 0.71 | KCNH2 (0.42) | HTR2AOPRM1OPRK1CHRM3ADRA1A |
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 |