Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 20/20 | 0.63 |
| ▸ | KCNH2 | Q12809 | 16/20 | 0.63 |
| ▸ | OPRK1 | P41145 | 6/20 | 0.63 |
| ▸ | CYP2D6 | P10635 | 11/20 | 0.51 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL471286 | 0.81 | OPRD1 (0.63) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| SCHEMBL467151 | 0.79 | OPRD1 (1.00) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| SCHEMBL471263 | 0.78 | OPRD1 (0.75) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| SCHEMBL471270 | 0.78 | OPRD1 (0.60) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| Hydrochloric Acid SCHEMBL12481185 | 0.78 | OPRD1 (0.97) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| SCHEMBL10259459 | 0.77 | OPRD1 (0.76) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| SCHEMBL10257844 | 0.76 | OPRD1 (0.60) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| SCHEMBL471272 | 0.76 | OPRD1 (0.77) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| SCHEMBL471265 | 0.74 | OPRD1 (0.74) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| SCHEMBL10258871 | 0.73 | OPRD1 (0.73) | OPRD1KCNH2OPRK1CYP2D6OPRM1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7638527-B2 | Spirocyclic heterocyclic derivatives and methods of their use | ADOLOR CORPORATION (US) | 2009-12-29 | — | — | US | disclosed |
| US-7638527-B2 | Spirocyclic heterocyclic derivatives and methods of their use | ADOLOR CORPORATION (US) | 2009-12-29 | — | — | US | disclosed |