Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 9/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 9/20 | 0.47 |
| ▸ | CXCR4 | P61073 | 4/20 | 0.44 |
| ▸ | PLK1 | P53350 | 1/20 | 0.43 |
| ▸ | APLNR | P35414 | 1/20 | 0.43 |
| ▸ | NMUR2 | Q9GZQ4 | 1/20 | 0.42 |
| ▸ | NMUR1 | Q9HB89 | 1/20 | 0.42 |
| ▸ | NPY4R | P50391 | 2/20 | 0.42 |
| ▸ | NPY1R | P25929 | 1/20 | 0.42 |
| ▸ | NPY2R | P49146 | 1/20 | 0.42 |
| ▸ | NPY5R | Q15761 | 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 | 1.00 | OPRM1 (0.47) | OPRM1OPRK1CXCR4PLK1APLNR | |
| Acetic Acid SCHEMBL30440885 | 0.97 | OPRM1 (0.48) | OPRM1OPRK1CXCR4PLK1APLNR | |
| SCHEMBL30440660 | 0.94 | OPRM1 (0.46) | OPRM1OPRK1CXCR4NMUR2NMUR1 | |
| SCHEMBL30585577 | 0.92 | OPRM1 (0.48) | OPRM1OPRK1PLK1NMUR2NMUR1 | |
| SCHEMBL30341827 | 0.90 | OPRM1 (0.43) | OPRM1OPRK1CXCR4NMUR2NMUR1 | |
| SCHEMBL29425244 | 0.90 | OPRM1 (0.43) | OPRM1OPRK1CXCR4NMUR2NMUR1 | |
| SCHEMBL2182409 | 0.90 | OPRM1 (0.43) | OPRM1OPRK1CXCR4NMUR2NMUR1 | |
| SCHEMBL11438170 | 0.90 | CXCR4 (0.43) | OPRM1OPRK1CXCR4PLK1NMUR2 | |
| Hydrochloric Acid SCHEMBL11594041 | 0.90 | OPRM1 (0.43) | OPRM1OPRK1CXCR4PLK1NMUR2 | |
| Hydrochloric Acid SCHEMBL11581218 | 0.90 | OPRM1 (0.43) | OPRM1OPRK1CXCR4PLK1NMUR2 |
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 |