Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 6/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | CALCRL | Q16602 | 1/20 | 0.37 |
| ▸ | RPLP1 | P05386 | 1/20 | 0.37 |
| ▸ | RPLP0 | P05388 | 1/20 | 0.37 |
| ▸ | RPS17 | P08708 | 1/20 | 0.37 |
| ▸ | RPSA | P08865 | 1/20 | 0.37 |
| ▸ | RPS2 | P15880 | 1/20 | 0.37 |
| ▸ | RPL35A | P18077 | 1/20 | 0.37 |
| ▸ | RPL7 | P18124 | 1/20 | 0.37 |
| ▸ | RPL17 | P18621 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL18285521 | 0.87 | OPRM1 (0.40) | OPRM1DRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL18285527 | 0.87 | OPRM1 (0.40) | OPRM1DRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL30111801 | 0.84 | HTR6 (0.40) | OPRM1ALDH1A1 | |
| SCHEMBL29737046 | 0.78 | SLC2A1 (0.36) | OPRM1ALDH1A1KCNH2KDM4EMAPT | |
| SCHEMBL32664297 | 0.78 | SLC2A1 (0.35) | OPRM1ALDH1A1CALCRLKCNH2KDM4E | |
| SCHEMBL31280171 | 0.78 | SLC2A1 (0.35) | OPRM1ALDH1A1CALCRLKCNH2KDM4E | |
| SCHEMBL31279004 | 0.77 | SLC2A1 (0.35) | OPRM1ALDH1A1PIK3CAMTORPRKDC | |
| SCHEMBL32664570 | 0.77 | SLC2A1 (0.35) | OPRM1ALDH1A1PIK3CAMTORPRKDC | |
| SCHEMBL32664703 | 0.77 | BACE1 (0.36) | OPRM1ALDH1A1KCNH2PIK3CAMTOR | |
| SCHEMBL31279119 | 0.77 | BACE1 (0.36) | OPRM1ALDH1A1KCNH2PIK3CAMTOR |
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-114380820-A | Hetero-fused ring derivative and application thereof in medicine | 海思科医药集团股份有限公司 | 2022-04-22 | — | — | CN | disclosed |