Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.44 |
| ▸ | DHFR | P00374 | 1/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1873958 | 1.00 | SLC6A3 (0.44) | SLC6A3SLC6A2SLC6A4DHFRCHRM2 | |
| SCHEMBL1875599 | 0.81 | CHRM3 (0.43) | SLC6A3SLC6A2SLC6A4DHFRCHRM2 | |
| SCHEMBL1872475 | 0.80 | MAPT (0.46) | SLC6A4CHRM2CHRM3LMNAMAPT | |
| SCHEMBL3065287 | 0.73 | KMT2A (0.44) | SLC6A3SLC6A2SLC6A4DHFRLMNA | |
| SCHEMBL7059883 | 0.73 | FAAH (0.53) | SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL27995321 | 0.72 | SLC6A3 (0.46) | SLC6A3SLC6A2SLC6A4DHFRLMNA | |
| SCHEMBL5807966 | 0.72 | MEN1 (0.69) | SLC6A4CHRM2CHRM3MAPTALDH1A1 | |
| SCHEMBL27861451 | 0.72 | SLC6A3 (0.40) | SLC6A3SLC6A2SLC6A4DHFRLMNA | |
| SCHEMBL10508162 | 0.72 | ALDH1A1 (0.44) | SLC6A3SLC6A2SLC6A4DHFRLMNA | |
| SCHEMBL27770641 | 0.72 | SLC6A3 (0.41) | SLC6A3SLC6A2SLC6A4DHFRLMNA |
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-7947730-B2 | Piperidinium and pyrrolidinium derivatives as ligands for the muscarinic M3 receptor | NOVARTIS AG (CH) | 2011-05-24 | — | — | US | disclosed |