Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 7/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 4/20 | 0.33 |
| ▸ | DRD3 | P35462 | 4/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.32 |
| ▸ | SLC6A9 | P48067 | 2/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29024060 | 0.86 | OPRM1 (0.34) | OPRM1EPHX2CHRM2CHRM4CHRM5 | |
| SCHEMBL28270921 | 0.84 | OPRM1 (0.35) | OPRM1EPHX2CHRM2CHRM4CHRM5 | |
| SCHEMBL28270989 | 0.83 | HSD11B1 (0.39) | OPRM1EPHX2CHRM2CHRM4CHRM5 | |
| SCHEMBL28272495 | 0.80 | GRIN1 (0.36) | OPRM1EPHX2CHRM2CHRM4CHRM5 | |
| SCHEMBL28869101 | 0.78 | CXCR3 (0.36) | OPRM1EPHX2DRD2DRD3SLC6A2 | |
| SCHEMBL29967398 | 0.69 | SLC6A2 (0.38) | OPRM1EPHX2DRD2DRD3SLC6A2 | |
| SCHEMBL29968052 | 0.68 | OPRM1 (0.57) | OPRM1 | |
| SCHEMBL28270902 | 0.68 | OPRM1 (0.57) | OPRM1 | |
| SCHEMBL29024043 | 0.67 | OPRM1 (0.37) | OPRM1CHRM2CHRM4CHRM5CHRM1 | |
| Hydrochloric Acid SCHEMBL29968182 | 0.67 | OPRM1 (0.56) | OPRM1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109206417-B | Opioid receptor agonists and uses thereof | 四川海思科制药有限公司 | 2023-01-03 | — | — | CN | disclosed |
| CN-115124520-A | Opioid receptor agonists and uses thereof | 四川海思科制药有限公司 | 2022-09-30 | — | — | CN | disclosed |