Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPY1R | P25929 | 1/20 | 0.57 |
| ▸ | HTT | P42858 | 1/20 | 0.57 |
| ▸ | NPY2R | P49146 | 1/20 | 0.57 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 8/20 | 0.42 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2895475 | 0.74 | NPY1R (0.67) | NPY1RHTTNPY2ROPRD1SIGMAR1 | |
| SCHEMBL11904808 | 0.71 | NPY1R (0.45) | NPY1RHTTNPY2ROPRD1SIGMAR1 | |
| SCHEMBL11967085 | 0.71 | NPY1R (0.45) | NPY1RHTTNPY2ROPRD1SIGMAR1 | |
| SCHEMBL11895898 | 0.71 | NPY1R (0.45) | NPY1RHTTNPY2ROPRD1SIGMAR1 | |
| SCHEMBL4765844 | 0.68 | CYP3A4 (0.43) | SIGMAR1 | |
| SCHEMBL2885978 | 0.67 | SIGMAR1 (0.54) | NPY1RHTTNPY2RSIGMAR1 | |
| SCHEMBL13379183 | 0.67 | NPY1R (0.82) | NPY1RHTTNPY2R | |
| SCHEMBL2890670 | 0.67 | NPY1R (0.82) | NPY1RHTTNPY2R | |
| SCHEMBL31562019 | 0.67 | SIGMAR1 (0.46) | OPRD1SIGMAR1 | |
| SCHEMBL9171764 | 0.66 | NPY1R (0.53) | NPY1RHTTNPY2ROPRD1SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011043954-A1 | NOVEL TRPA1 ANTAGONISTS | MERCK SHARP & DOHME CORP. (US) | 2011-04-14 | — | — | WO | disclosed |