Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPY4R | P50391 | 13/20 | 0.46 |
| ▸ | NPY1R | P25929 | 8/20 | 0.46 |
| ▸ | ITGB3 | P05106 | 3/20 | 0.42 |
| ▸ | ITGA2B | P08514 | 3/20 | 0.42 |
| ▸ | NPY5R | Q15761 | 8/20 | 0.41 |
| ▸ | NPY2R | P49146 | 5/20 | 0.41 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | MME | P08473 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9207694 | 1.00 | NPY4R (0.46) | NPY4RNPY1RITGB3ITGA2BNPY5R | |
| SCHEMBL23408816 | 0.86 | ITGB3 (0.46) | NPY4RNPY1RITGB3ITGA2BNPY5R | |
| SCHEMBL18465137 | 0.86 | NPY4R (0.43) | NPY4RNPY1RNPY5RNPY2RFOLH1 | |
| SCHEMBL27846680 | 0.85 | NPY4R (0.42) | NPY4RNPY1RNPY5RNPY2RFOLH1 | |
| SCHEMBL12655514 | 0.85 | ITGB3 (0.42) | NPY4RNPY1RITGB3ITGA2BNPY5R | |
| SCHEMBL17015152 | 0.83 | NPY4R (0.50) | NPY4RNPY1RNPY5RNPY2RFOLH1 | |
| SCHEMBL2390736 | 0.83 | NPY4R (0.44) | NPY4RNPY1RNPY5RNPY2RFOLH1 | |
| SCHEMBL21879809 | 0.83 | NPY4R (0.44) | NPY4RNPY1RNPY5RNPY2RFOLH1 | |
| SCHEMBL5807981 | 0.83 | NPY4R (0.44) | NPY4RNPY1RNPY5RNPY2RFOLH1 | |
| SCHEMBL21782578 | 0.82 | NPY4R (0.49) | NPY4RNPY1RNPY5RNPY2RFOLH1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0506468-B1 | N-substituted 4-phenyl-piperidine opioid-antagonists | LILLY CO ELI (US) | 1995-04-26 | — | — | EP | disclosed |
| US-5270328-A | Peripherally selective piperidine opioid antagonists | ELI LILLY AND COMPANY (US) | 1993-12-14 | — | — | US | disclosed |
| US-5159081-A | INTERMEDIATES OF PERIPHERALLY SELECTIVE N-CARBONYL-3,4,4-TRISUBSTITUTED PIPERIDINE OPIOID ANTAGONISTS | ELI LILLY AND COMPANY (US) | 1992-10-27 | — | — | US | disclosed |
| EP-0506468-A1 | N-substituted 4-phenyl-piperidine opioid-antagonists | ELI LILLY AND COMPANY (US) | 1992-09-30 | — | — | EP | disclosed |