Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | MLYCD | O95822 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | BDKRB1 | P46663 | 1/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.35 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.35 |
| ▸ | SLC8A1 | P32418 | 1/20 | 0.34 |
| ▸ | NPY1R | P25929 | 1/20 | 0.34 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4968562 | 0.93 | HDAC6 (0.45) | HDAC6OPRM1OPRD1OPRK1HDAC3 | |
| Trifluoroacetic Acid SCHEMBL4964203 | 0.86 | OPRM1 (0.52) | HDAC6OPRM1OPRD1OPRK1MLYCD | |
| SCHEMBL4966598 | 0.86 | MCHR1 (0.41) | HDAC6OPRM1OPRD1OPRK1KDM4E | |
| SCHEMBL4965823 | 0.81 | MEN1 (0.45) | HDAC1KDM4EALDH1A1POLBSLC8A1 | |
| SCHEMBL4963719 | 0.81 | MEN1 (0.45) | HDAC1KDM4EALDH1A1POLBSLC8A1 | |
| SCHEMBL4968023 | 0.79 | OPRM1 (0.46) | OPRM1OPRD1OPRK1POLBITGB3 | |
| SCHEMBL5332629 | 0.78 | OPRM1 (0.58) | HDAC6OPRM1OPRD1OPRK1MLYCD | |
| SCHEMBL4965887 | 0.78 | OPRM1 (0.58) | HDAC6OPRM1OPRD1OPRK1MLYCD | |
| SCHEMBL4964207 | 0.78 | OPRM1 (0.38) | HDAC6OPRM1OPRD1OPRK1MLYCD | |
| SCHEMBL4965252 | 0.76 | OPRM1 (0.41) | OPRM1OPRD1OPRK1KDM4EPOLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1730140-B1 | OPIOID RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-06-25 | — | — | EP | claimed |