Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.40 |
| ▸ | HTR3B | O95264 | 1/20 | 0.40 |
| ▸ | HTR3A | P46098 | 1/20 | 0.40 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.40 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1012159 | 0.77 | CYP1A2 (0.51) | SLC6A3SLC6A4SLC6A2CHRM2CHRM4 | |
| SCHEMBL14639593 | 0.73 | BRD4 (0.38) | SLC6A3SLC6A4SLC6A2 | |
| SCHEMBL6357679 | 0.72 | ALDH1A1 (0.36) | SLC6A3SLC6A4SLC6A2CHRM2CHRM4 | |
| SCHEMBL6358539 | 0.71 | ALDH1A1 (0.36) | CHRM2CHRM4CHRM3HTR3EHTR3B | |
| SCHEMBL6357052 | 0.71 | ALDH1A1 (0.36) | CHRM2CHRM4CHRM3 | |
| SCHEMBL12955041 | 0.70 | SMN1; SMN2 (0.34) | — | |
| SCHEMBL9730177 | 0.70 | ALDH1A1 (0.46) | — | |
| SCHEMBL6358677 | 0.70 | ALDH1A1 (0.35) | SLC6A3CHRM2CHRM4CHRM3HTR3E | |
| SCHEMBL16592162 | 0.69 | CHRM2 (0.66) | SLC6A3SLC6A4SLC6A2CHRM2CHRM4 | |
| SCHEMBL15239506 | 0.69 | CHRM2 (0.66) | SLC6A3SLC6A4SLC6A2CHRM2CHRM4 |
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-1118674-B1 | PROCESS FOR PRODUCING OPTICALLY ACTIVE TROPINONE MONOCARBOXYLIC ACID DERIVATIVE | NIHON MEDIPHYSICS CO LTD (JP) | 2011-01-05 | — | — | EP | disclosed |