Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H3 | Q13133 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 6/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 6/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 6/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.41 |
| ▸ | LPAR5 | Q9H1C0 | 1/20 | 0.41 |
| ▸ | NNMT | P40261 | 1/20 | 0.41 |
| ▸ | DHFR | P00374 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.40 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6228196 | 0.89 | OPRM1 (0.42) | OPRM1OPRD1OPRK1LPAR1LPAR5 | |
| SCHEMBL6203347 | 0.88 | NR1H3 (0.45) | NR1H3OPRM1OPRD1OPRK1ABCB1 | |
| SCHEMBL1533182 | 0.88 | KDM4E (0.40) | NR1H3OPRM1LPAR1LPAR5DHFR | |
| SCHEMBL6223567 | 0.83 | ABCB1 (0.41) | NR1H3OPRM1OPRD1OPRK1ABCB1 | |
| SCHEMBL6226873 | 0.83 | ALDH1A1 (0.43) | NR1H3OPRM1OPRD1OPRK1ABCB1 | |
| SCHEMBL6204877 | 0.82 | OPRM1 (0.43) | OPRM1OPRD1OPRK1GRIN2DGRIN3B | |
| SCHEMBL6224928 | 0.80 | OPRM1 (0.38) | OPRM1OPRD1OPRK1ABCB1NNMT | |
| SCHEMBL3692313 | 0.78 | OPRM1 (0.53) | OPRM1OPRD1OPRK1KDM4EGRIN2D | |
| SCHEMBL6224920 | 0.78 | OPRM1 (0.43) | OPRM1OPRD1OPRK1NNMTGRIN2D | |
| SCHEMBL6691658 | 0.78 | OPRM1 (0.50) | OPRM1OPRD1OPRK1LPAR1LPAR5 |
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-1562595-A1 | DIARYL ETHERS AS OPIOID RECEPTOR ANTAGONISTS | ELI LILLY AND COMPANY (US) | 2005-08-17 | — | — | EP | disclosed |
| WO-2004026305-A1 | DIARYL ETHERS AS OPIOID RECEPTOR ANTAGONIST | ELI LILLY AND COMPANY (US) | 2004-04-01 | — | — | WO | disclosed |