Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRL1 | P41146 | 2/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.37 |
| ▸ | TACR1 | P25103 | 2/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | AVPR1A | P37288 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | AVPR1B | P47901 | 1/20 | 0.35 |
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.35 |
| ▸ | PKLR | P30613 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 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 | |
|---|---|---|---|---|
| Tert-Butyl Formate SCHEMBL28818068 | 0.87 | DRD2 (0.40) | TACR1TDP1 | |
| Tert-Butyl Formate SCHEMBL28821595 | 0.86 | OPRL1 (0.38) | OPRL1OPRM1OPRD1OPRK1NR3C1 | |
| Tert-Butyl Formate SCHEMBL28023816 | 0.85 | FDPS (0.37) | PKLRALDH1A1CYP2C9 | |
| Tert-Butyl Formate SCHEMBL27935398 | 0.85 | GAA (0.40) | SLC6A2SLC6A4SLC6A3TDP1MEN1 | |
| Tert-Butyl Formate SCHEMBL28114746 | 0.84 | MEN1 (0.42) | OPRM1MEN1ALDH1A1KMT2A | |
| Tert-Butyl Formate SCHEMBL28314943 | 0.84 | MAOA (0.50) | OPRM1TACR1SLC6A2SLC6A4SLC6A3 | |
| Tert-Butyl Formate SCHEMBL28797112 | 0.83 | OPRM1 (0.33) | OPRM1TACR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL613290 | 0.82 | OPRL1 (0.51) | OPRL1OPRM1OPRD1OPRK1NR3C1 | |
| Tert-Butyl Formate SCHEMBL28023820 | 0.81 | CYP46A1 (0.40) | SLC6A2SLC6A4SLC6A3CYP46A1PKLR | |
| Tert-Butyl Formate SCHEMBL28818064 | 0.81 | FPR2 (0.43) | SLC6A2SLC6A4SLC6A3 |
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-110177786-A | Pyrazolo [1,5-A] pyridine compounds being substituted are as RET kinase inhibitor | 阿雷生物药品公司 | 2019-08-27 | — | — | CN | disclosed |