Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 3/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | SLC18A3 | Q16572 | 3/20 | 0.35 |
| ▸ | GBA1 | P04062 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | FUCA1 | P04066 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | AKR1C1 | Q04828 | 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 | |
|---|---|---|---|---|
| SCHEMBL19668060 | 1.00 | SLC6A2 (0.47) | SLC6A2SLC6A3ADRA1AHTR2BCYP2C19 | |
| SCHEMBL19668081 | 1.00 | SLC6A2 (0.47) | SLC6A2SLC6A3ADRA1AHTR2BCYP2C19 | |
| SCHEMBL13778756 | 0.84 | SLC6A2 (0.53) | SLC6A2SLC6A3ADRA1AHTR2BCYP2C19 | |
| SCHEMBL17029481 | 0.84 | SLC6A2 (0.53) | SLC6A2SLC6A3ADRA1AHTR2BCYP2C19 | |
| SCHEMBL5019139 | 0.84 | SLC6A2 (0.53) | SLC6A2SLC6A3ADRA1AHTR2BCYP2C19 | |
| SCHEMBL9220859 | 0.76 | SMN1; SMN2 (0.44) | SLC6A2SLC6A3ADRA1AHTR2BCYP2C19 | |
| SCHEMBL4171302 | 0.76 | SMN1; SMN2 (0.44) | SLC6A2SLC6A3ADRA1AHTR2BCYP2C19 | |
| SCHEMBL4171081 | 0.70 | MAOB (0.48) | SLC6A2SLC6A3ADRA1AHTR2BCYP2C19 | |
| SCHEMBL4171085 | 0.70 | MAOB (0.48) | SLC6A2SLC6A3ADRA1AHTR2BCYP2C19 | |
| SCHEMBL4790557 | 0.70 | SMN1; SMN2 (0.46) | SLC6A2SLC6A3ADRA1AHTR2BCYP2C19 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3464258-A1 | TETRAHYDROPYRANYL LOWER ALKYL ESTERS AND THE PRODUCTION OF SAME USING A KETENE COMPOUND | BASF SE (DE) | 2019-04-10 | — | — | EP | disclosed |
| WO-2017207539-A1 | TETRAHYDROPYRANYL LOWER ALKYL ESTERS AND THE PRODUCTION OF SAME USING A KETENE COMPOUND | BASF SE (DE) | 2017-12-07 | — | — | WO | disclosed |