Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 8/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 6/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.44 |
| ▸ | HTR1A | P08908 | 6/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.42 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.42 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | CHRM5 | P08912 | 6/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL10686163 | 1.00 | SLC6A2 (0.48) | SLC6A2SLC6A4SLC6A3CHRM2CHRM3 | |
| SCHEMBL10685764 | 0.88 | SLC6A2 (0.46) | SLC6A2SLC6A4SLC6A3CHRM2CHRM3 | |
| SCHEMBL10685768 | 0.88 | SLC6A2 (0.46) | SLC6A2SLC6A4SLC6A3CHRM2CHRM3 | |
| SCHEMBL10690284 | 0.86 | HTR1A (0.46) | CHRM2CHRM3CHRM4CHRM1HTR1A | |
| SCHEMBL10690281 | 0.86 | HTR1A (0.46) | CHRM2CHRM3CHRM4CHRM1HTR1A | |
| SCHEMBL10685696 | 0.85 | SLC6A2 (0.43) | SLC6A2SLC6A4SLC6A3CHRM2CHRM3 | |
| SCHEMBL10685699 | 0.85 | SLC6A2 (0.43) | SLC6A2SLC6A4SLC6A3CHRM2CHRM3 | |
| SCHEMBL6481644 | 0.84 | SLC6A2 (0.51) | SLC6A2SLC6A4SLC6A3DRD2HTR2C | |
| SCHEMBL937164 | 0.84 | SLC6A2 (0.51) | SLC6A2SLC6A4SLC6A3DRD2HTR2C | |
| SCHEMBL10686908 | 0.84 | ALDH1A1 (0.49) | SLC6A2SLC6A4SLC6A3CHRM2CHRM3 |
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 |
|---|---|---|---|---|---|---|---|
| US-4755323-A | Mixture of liquid crystalline compounds including substituted para-dioxane | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1988-07-05 | — | — | US | disclosed |