Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL7694829 | 0.76 | HTR2A (0.46) | HTR2ACYP2D6ACHEKDM4EMEN1 | |
| SCHEMBL7698618 | 0.75 | HTR2A (0.41) | HTR2AOPRM1OPRD1OPRK1ACHE | |
| SCHEMBL7698617 | 0.75 | HTR2A (0.41) | HTR2ACYP2D6OPRM1OPRD1OPRK1 | |
| SCHEMBL7698615 | 0.72 | LTA4H (0.48) | HTR2AACHEMEN1KMT2ASIGMAR1 | |
| SCHEMBL7707462 | 0.72 | ACHE (0.44) | HTR2AACHEBCHE | |
| SCHEMBL7705772 | 0.72 | SIGMAR1 (0.41) | HTR2AOPRM1SIGMAR1 | |
| SCHEMBL7695892 | 0.71 | HTR2A (0.45) | HTR2ACYP2D6ACHEMEN1KMT2A | |
| SCHEMBL7700571 | 0.70 | ACHE (0.42) | HTR2AACHESIGMAR1 | |
| SCHEMBL7695908 | 0.70 | HTR2A (0.43) | HTR2ACYP2D6OPRM1ACHEMEN1 | |
| SCHEMBL7697015 | 0.69 | KCNH2 (0.42) | HTR2AOPRM1OPRD1OPRK1ACHE |
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 |