Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 4/20 | 0.50 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.50 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.50 |
| ▸ | HTR1A | P08908 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.44 |
| ▸ | GBA1 | P04062 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL21071992 | 1.00 | OPRM1 (0.50) | OPRM1OPRD1OPRK1HTR1ADRD2 | |
| SCHEMBL21072109 | 0.76 | DRD3 (0.46) | OPRM1OPRD1OPRK1HTR1ADRD2 | |
| SCHEMBL19852248 | 0.76 | DRD3 (0.46) | OPRM1OPRD1OPRK1HTR1ADRD2 | |
| SCHEMBL21071714 | 0.75 | OPRM1 (0.82) | OPRM1OPRD1OPRK1HTR1ADRD2 | |
| SCHEMBL21142567 | 0.75 | OPRM1 (0.82) | OPRM1OPRD1OPRK1HTR1ADRD2 | |
| SCHEMBL5041464 | 0.73 | CHRNB2 (0.55) | OPRM1 | |
| SCHEMBL31119577 | 0.73 | CHRNB2 (0.45) | MAPTSLC6A3SIGMAR1SLC6A2 | |
| SCHEMBL7523207 | 0.72 | SLC6A3 (0.57) | HTR1ADRD2SLC6A3GBA1HRH3 | |
| SCHEMBL9585610 | 0.72 | SLC6A3 (0.49) | OPRM1OPRD1HTR1ADRD2SLC6A3 | |
| SCHEMBL7003079 | 0.71 | SLC6A3 (0.61) | HTR1ADRD2SLC6A3GBA1HRH3 |
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-2018026371-A1 | DUAL NAV1.2/5HT2A INHIBITORS FOR TREATING CNS DISORDERS | SUNOVION PHARMACEUTICALS INC. (US) | 2018-02-08 | — | — | WO | disclosed |