Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 17/20 | 0.78 |
| ▸ | OPRD1 | P41143 | 12/20 | 0.78 |
| ▸ | OPRK1 | P41145 | 13/20 | 0.74 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.62 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.62 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL3763241 | 1.00 | OPRM1 (0.78) | OPRM1OPRD1OPRK1KCNE1KCNQ1 | |
| SCHEMBL1705349 | 1.00 | OPRM1 (0.78) | OPRM1OPRD1OPRK1KCNE1KCNQ1 | |
| SCHEMBL12997002 | 1.00 | OPRM1 (0.78) | OPRM1OPRD1OPRK1KCNE1KCNQ1 | |
| SCHEMBL1705344 | 1.00 | OPRM1 (0.78) | OPRM1OPRD1OPRK1KCNE1KCNQ1 | |
| SCHEMBL3726859 | 0.94 | OPRM1 (0.74) | OPRM1OPRD1OPRK1KCNE1KCNQ1 | |
| SCHEMBL12587737 | 0.94 | OPRM1 (0.73) | OPRM1OPRD1OPRK1KCNE1KCNQ1 | |
| SCHEMBL12997060 | 0.94 | OPRM1 (0.73) | OPRM1OPRD1OPRK1KCNE1KCNQ1 | |
| SCHEMBL12555224 | 0.94 | OPRM1 (0.73) | OPRM1OPRD1OPRK1KCNE1KCNQ1 | |
| SCHEMBL1217627 | 0.93 | OPRM1 (0.81) | OPRM1OPRD1OPRK1KCNE1KCNQ1 | |
| SCHEMBL1705321 | 0.92 | OPRM1 (0.70) | OPRM1OPRD1OPRK1KCNE1KCNQ1 |
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-2010144446-A1 | (S) -2-BENZYL-3- ( (3R, 4R) -4- (3 -CARBAMO YLPHENYL) -3, 4-DIMETHYLPIPERIDINYL) PROPANOIC ACID AND SALT THEROF AS ANTAGONISTS OF THE OPIOID RECEPTORS | ADOLOR CORPORATION (US) | 2010-12-16 | — | — | WO | disclosed |