Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 7/20 | 0.61 |
| ▸ | OPRD1 | P41143 | 6/20 | 0.61 |
| ▸ | OPRK1 | P41145 | 6/20 | 0.61 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.43 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.43 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.43 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.43 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | PPARD | Q03181 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3696666 | 0.92 | OPRM1 (0.63) | OPRM1OPRD1OPRK1ROCK1GRIN2D | |
| SCHEMBL3700784 | 0.91 | OPRM1 (0.60) | OPRM1OPRD1OPRK1ROCK1GRIN2D | |
| SCHEMBL3695213 | 0.87 | OPRM1 (0.57) | OPRM1OPRD1OPRK1ROCK1GRIN2D | |
| SCHEMBL3696696 | 0.86 | OPRM1 (0.61) | OPRM1OPRD1OPRK1ROCK1GRIN2D | |
| SCHEMBL3692278 | 0.86 | OPRM1 (0.61) | OPRM1OPRD1OPRK1ROCK1GRIN2D | |
| SCHEMBL3695517 | 0.85 | OPRM1 (0.52) | OPRM1OPRD1OPRK1PPARDCARM1 | |
| SCHEMBL3689306 | 0.85 | OPRM1 (0.52) | OPRM1OPRD1OPRK1PPARDCARM1 | |
| SCHEMBL13773070 | 0.85 | OPRM1 (0.52) | OPRM1OPRD1OPRK1CYP3A4CYP2D6 | |
| SCHEMBL3698265 | 0.84 | OPRM1 (0.50) | OPRM1OPRD1OPRK1PPARDCARM1 | |
| SCHEMBL3698271 | 0.84 | OPRM1 (0.50) | OPRM1OPRD1OPRK1PPARDCARM1 |
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 |