Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 9/20 | 0.46 |
| ▸ | OPRK1 | P41145 | 9/20 | 0.46 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.45 |
| ▸ | NMUR2 | Q9GZQ4 | 2/20 | 0.43 |
| ▸ | NMUR1 | Q9HB89 | 2/20 | 0.43 |
| ▸ | NTSR2 | O95665 | 3/20 | 0.42 |
| ▸ | NTSR1 | P30989 | 3/20 | 0.42 |
| ▸ | EPHA2 | P29317 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30440639 | 0.94 | OPRM1 (0.47) | OPRM1OPRK1CXCR4NMUR2NMUR1 | |
| SCHEMBL30440642 | 0.94 | OPRM1 (0.47) | OPRM1OPRK1CXCR4NMUR2NMUR1 | |
| Acetic Acid SCHEMBL30440885 | 0.93 | OPRM1 (0.48) | OPRM1OPRK1CXCR4NMUR2NMUR1 | |
| SCHEMBL29557983 | 0.92 | OPRM1 (0.49) | OPRM1OPRK1NMUR2NMUR1NTSR2 | |
| SCHEMBL29701311 | 0.91 | OPRM1 (0.46) | OPRM1OPRK1CXCR4NMUR2NMUR1 | |
| SCHEMBL29802094 | 0.91 | OPRM1 (0.45) | OPRM1OPRK1NMUR2NMUR1EPHA2 | |
| SCHEMBL29608389 | 0.91 | OPRM1 (0.51) | OPRM1OPRK1CXCR4NMUR2NMUR1 | |
| SCHEMBL29801896 | 0.91 | NRP1 (0.42) | OPRM1OPRK1NMUR2NMUR1EPHA2 | |
| SCHEMBL9616907 | 0.90 | OPRK1 (0.43) | OPRM1OPRK1CXCR4 | |
| SCHEMBL9616909 | 0.90 | OPRK1 (0.43) | OPRM1OPRK1CXCR4 |
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-116217672-A | Pure gonadotropin releasing hormone antagonist cetrorelix | 海南中和药业股份有限公司 | 2023-06-06 | — | — | CN | disclosed |