Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4C | Q9H3R0 | 12/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 7/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 6/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5712741 | 0.91 | OPRM1 (0.45) | KDM4COPRM1OPRD1OPRK1 | |
| SCHEMBL5712736 | 0.90 | OPRM1 (0.46) | KDM4COPRM1OPRD1OPRK1 | |
| SCHEMBL5712653 | 0.86 | OPRM1 (0.48) | KDM4COPRM1OPRD1OPRK1HRH3 | |
| SCHEMBL388730 | 0.84 | OPRM1 (0.55) | OPRM1OPRD1OPRK1HRH3 | |
| SCHEMBL388546 | 0.83 | KDM4C (0.43) | KDM4COPRM1OPRD1OPRK1HRH3 | |
| SCHEMBL388353 | 0.83 | OPRM1 (0.56) | OPRM1OPRD1OPRK1HRH3 | |
| SCHEMBL5712689 | 0.82 | KDM4C (0.45) | KDM4C | |
| SCHEMBL5712642 | 0.81 | OPRM1 (0.48) | KDM4COPRM1OPRD1OPRK1 | |
| SCHEMBL388179 | 0.79 | OPRM1 (0.55) | OPRM1OPRD1OPRK1HRH3 | |
| SCHEMBL388189 | 0.77 | OPRM1 (0.57) | OPRM1OPRD1OPRK1HRH3 |
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-A1 | 6-SUBSTITUTED NICOTINAMIDE DERIVATIVES AS OPIOID RECEPTOR ANTAGONISTS | Eli Lilly and Company (US) | 2006-01-11 | — | — | EP | claimed |
| WO-2004080968-A1 | 6-SUBSTITUTED NICOTINAMIDE DERIVATIVES AS OPIOID RECEPTOR ANTAGONISTS | ELI LILLY AND COMPANY (US) | 2004-09-23 | — | — | WO | claimed |