Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 11/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 10/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 10/20 | 0.46 |
| ▸ | HTR1A | P08908 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MLNR | O43193 | 1/20 | 0.46 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.46 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.46 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | MC4R | P32245 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL21401236 | 0.86 | SLC6A2 (0.46) | SLC6A4SLC6A2SLC6A3HTR1AGAA | |
| SCHEMBL20917121 | 0.78 | CACNA2D1 (0.51) | SLC6A2CACNA2D1KDM4EMAPT | |
| SCHEMBL21102467 | 0.77 | SLC6A2 (0.44) | SLC6A4SLC6A2SLC6A3HTR1AGAA | |
| SCHEMBL21102466 | 0.75 | SLC6A2 (0.43) | SLC6A4SLC6A2SLC6A3HTR1AGAA | |
| SCHEMBL21102736 | 0.75 | SLC6A2 (0.47) | SLC6A4SLC6A2SLC6A3HTR1AGAA | |
| SCHEMBL4087510 | 0.74 | ALDH1A1 (0.42) | SLC6A4SLC6A2SLC6A3KMT2ATSHR | |
| SCHEMBL4091564 | 0.74 | ALDH1A1 (0.42) | SLC6A4SLC6A2SLC6A3KMT2ATSHR | |
| SCHEMBL21242102 | 0.74 | CACNA2D1 (0.54) | SLC6A4SLC6A2SLC6A3HTR1AGAA | |
| SCHEMBL4563199 | 0.74 | SLC6A2 (0.76) | SLC6A4SLC6A2SLC6A3HTR1AGAA | |
| SCHEMBL21102962 | 0.73 | SLC6A2 (0.45) | SLC6A4SLC6A2SLC6A3HTR1AGAA |
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-2019115008-A1 | DIALKYLAMINOARYLPIPERIDINYL-O-PHENOXY AND O-BENZYLOXYPROPYLAMINO DERIVATIVES HAVING MULTIMODAL ACTIVITY AGAINST PAIN | ESTEVE PHARMACEUTICALS, S.A. (ES) | 2019-06-20 | — | — | WO | disclosed |