Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 17/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.49 |
| ▸ | OPRD1 | P41143 | 16/20 | 0.48 |
| ▸ | OPRK1 | P41145 | 13/20 | 0.48 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.47 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL5182792 | 0.91 | OPRM1 (0.58) | OPRM1HRH3OPRD1OPRK1ADRB1 | |
| SCHEMBL5182847 | 0.91 | OPRM1 (0.58) | OPRM1HRH3OPRD1OPRK1ADRB1 | |
| SCHEMBL385665 | 0.90 | OPRM1 (0.57) | OPRM1HRH3OPRD1OPRK1ADRB1 | |
| SCHEMBL5181385 | 0.89 | OPRM1 (0.57) | OPRM1HRH3OPRD1OPRK1 | |
| SCHEMBL5183240 | 0.87 | OPRM1 (0.59) | OPRM1HRH3OPRD1OPRK1 | |
| SCHEMBL388291 | 0.86 | OPRM1 (0.63) | OPRM1HRH3OPRD1OPRK1 | |
| SCHEMBL387293 | 0.85 | OPRM1 (0.57) | OPRM1HRH3OPRD1OPRK1ADRB1 | |
| SCHEMBL5181309 | 0.84 | OPRM1 (0.52) | OPRM1HRH3OPRD1OPRK1ADRB1 | |
| SCHEMBL387613 | 0.84 | OPRM1 (0.58) | OPRM1HRH3OPRD1OPRK1ADRB1 | |
| SCHEMBL388396 | 0.84 | OPRM1 (0.64) | OPRM1HRH3OPRD1OPRK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1613597-B1 | 6-SUBSTITUTED NICOTINAMIDE DERIVATIVES AS OPIOID RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2007-11-07 | — | — | EP | claimed |
| EP-1613597-B1 | 6-SUBSTITUTED NICOTINAMIDE DERIVATIVES AS OPIOID RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2007-11-07 | — | — | EP | disclosed |