Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1B | P49286 | 1/20 | 0.52 |
| ▸ | ACE | P12821 | 2/20 | 0.47 |
| ▸ | HHAT | Q5VTY9 | 3/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.43 |
| ▸ | KEAP1 | Q14145 | 5/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.41 |
| ▸ | XIAP | P98170 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL22230749 | 1.00 | MTNR1B (0.52) | MTNR1BACEHHATCYP2D6OPRM1 | |
| SCHEMBL5334773 | 0.85 | ACE (0.45) | MTNR1BACEHHATCYP2D6ATM | |
| SCHEMBL5332110 | 0.82 | OPRM1 (0.57) | MTNR1BCYP2D6OPRM1OPRK1OPRD1 | |
| SCHEMBL14304627 | 0.79 | MTNR1B (0.48) | MTNR1BACEHHATOPRM1OPRK1 | |
| SCHEMBL15580121 | 0.79 | OPRM1 (0.49) | MTNR1BACEHHATCYP2D6OPRM1 | |
| SCHEMBL18067412 | 0.78 | MTNR1B (0.47) | MTNR1BACEHHATOPRM1OPRK1 | |
| SCHEMBL28802299 | 0.78 | OPRM1 (0.51) | MTNR1BACEHHATCYP2D6OPRM1 | |
| SCHEMBL14279593 | 0.78 | MTNR1B (0.47) | MTNR1BACEHHATCYP2D6OPRM1 | |
| SCHEMBL28866519 | 0.75 | PRCP (0.42) | MTNR1BACEXIAP | |
| SCHEMBL21236187 | 0.75 | PRCP (0.45) | ACE |
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-112334465-B | Tricyclic substituted oxaspiro derivatives, preparation and pharmaceutical use thereof | 上海海雁医药科技有限公司 | 2024-06-11 | — | — | CN | disclosed |