Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | TACR1 | P25103 | 8/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | ATP1A1 | P05023 | 2/20 | 0.35 |
| ▸ | ATP1B1 | P05026 | 2/20 | 0.35 |
| ▸ | ATP1A3 | P13637 | 2/20 | 0.35 |
| ▸ | ATP1B2 | P14415 | 2/20 | 0.35 |
| ▸ | ATP1A2 | P50993 | 2/20 | 0.35 |
| ▸ | ATP1B3 | P54709 | 2/20 | 0.35 |
| ▸ | FXYD2 | P54710 | 2/20 | 0.35 |
| ▸ | ATP1A4 | Q13733 | 2/20 | 0.35 |
| ▸ | KDM1A | O60341 | 3/20 | 0.34 |
| ▸ | MAOA | P21397 | 3/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.34 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4665556 | 0.84 | SIGMAR1 (0.39) | CHRM2CHRM1SIGMAR1ATP1A1ATP1B1 | |
| SCHEMBL4667320 | 0.81 | OPRK1 (0.50) | CHRM2CHRM1OPRM1OPRD1OPRK1 | |
| SCHEMBL5719790 | 0.78 | ATP1A1 (0.33) | TACR1ATP1A1ATP1B1ATP1A3ATP1B2 | |
| SCHEMBL4664155 | 0.78 | OPRK1 (0.38) | CHRM2CHRM1TACR1ATP1A1ATP1B1 | |
| SCHEMBL4663722 | 0.75 | MAOA (0.35) | TACR1ATP1A1ATP1B1ATP1A3ATP1B2 | |
| SCHEMBL4664194 | 0.75 | TACR1 (0.34) | TACR1ATP1A1ATP1B1ATP1A3ATP1B2 | |
| SCHEMBL4667252 | 0.74 | OPRM1 (0.37) | SIGMAR1ATP1A1ATP1B1ATP1A3ATP1B2 | |
| SCHEMBL4663548 | 0.73 | OPRM1 (0.41) | CHRM2CHRM4CHRM5CHRM1CHRM3 | |
| SCHEMBL4665510 | 0.72 | SIGMAR1 (0.36) | SIGMAR1ATP1A1ATP1B1ATP1A3ATP1B2 | |
| SCHEMBL6939500 | 0.71 | SLC6A2 (0.47) | CHRM2CHRM1SIGMAR1OPRM1OPRD1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1571140-B1 | C-substituted cyclohexylmethylamine derivatives | GRUENENTHAL GMBH (DE) | 2008-11-12 | — | — | EP | claimed |