Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 5/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | ELOVL1 | Q9BW60 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.37 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.36 |
| ▸ | USP28 | Q96RU2 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20025429 | 0.88 | ABL1 (0.40) | LRRK2OPRM1OPRL1SLC6A2SLC6A4 | |
| SCHEMBL20025478 | 0.84 | LRRK2 (0.41) | LRRK2SLC6A2SLC6A4SLC6A3ELOVL1 | |
| SCHEMBL20025487 | 0.81 | LRRK2 (0.43) | LRRK2SLC6A2SLC6A4SLC6A3ELOVL1 | |
| SCHEMBL20025485 | 0.79 | LRRK2 (0.42) | LRRK2SLC6A2SLC6A4SLC6A3ELOVL1 | |
| SCHEMBL20025492 | 0.79 | ADRB1 (0.61) | LRRK2SLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL20025012 | 0.78 | ALDH1A1 (0.60) | SLC6A2SLC6A4SLC6A3ALDH1A1HSD17B10 | |
| SCHEMBL20025300 | 0.78 | EIF2AK4 (0.45) | PIK3CAMTORNAMPTEIF2AK4 | |
| SCHEMBL20025468 | 0.77 | SLC6A2 (0.41) | LRRK2OPRL1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL11919149 | 0.77 | ADRB1 (0.55) | OPRM1OPRL1AOC3ADRB1 | |
| SCHEMBL25147567 | 0.76 | LRRK2 (0.43) | LRRK2OPRM1OPRL1ALDH1A1PIK3CA |
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-2018059537-A1 | DIAZASPIRO[5.5]UNDECANE DERIVATIVE AND USE THEREOF | 四川海思科制药有限公司 | 2018-04-05 | — | — | WO | disclosed |