Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A1 | O15245 | 1/20 | 0.66 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.66 |
| ▸ | HTR2A | P28223 | 3/20 | 0.55 |
| ▸ | HRH1 | P35367 | 3/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 7/20 | 0.53 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 7/20 | 0.53 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.44 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5345026 | 0.81 | OPRM1 (0.67) | SLC22A1OPRM1TDP1SLC6A2SLC6A4 | |
| SCHEMBL168864 | 0.81 | OPRM1 (0.67) | SLC22A1OPRM1TDP1SLC6A2SLC6A4 | |
| SCHEMBL11889571 | 0.81 | HTR2A (0.52) | SLC22A1OPRM1HTR2AHRH1TDP1 | |
| SCHEMBL22009966 | 0.81 | HKDC1 (0.52) | SLC22A1OPRM1TDP1SLC6A2SLC6A3 | |
| SCHEMBL12311676 | 0.81 | SLC22A1 (0.70) | SLC22A1OPRM1HTR2AHRH1TDP1 | |
| SCHEMBL13886378 | 0.81 | SLC22A1 (0.70) | SLC22A1OPRM1HTR2AHRH1TDP1 | |
| SCHEMBL6411376 | 0.81 | SLC22A1 (0.70) | SLC22A1OPRM1HTR2AHRH1TDP1 | |
| SCHEMBL15024192 | 0.81 | SLC22A1 (0.70) | SLC22A1OPRM1HTR2AHRH1TDP1 | |
| Hydrochloric Acid SCHEMBL28308661 | 0.80 | OPRM1 (0.65) | SLC22A1OPRM1TDP1SLC6A2SLC6A4 | |
| Tapentadol SCHEMBL416917 | 0.80 | OPRM1 (1.00) | SLC22A1OPRM1HTR2AHRH1TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110015955-A | The salt or eutectic of 3- (3- dimethylamino -1- Ethyl-2-Methyl-propyl)-phenol | 格吕伦塔尔有限公司 | 2019-07-16 | — | — | CN | disclosed |