Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 6/20 | 0.70 |
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.70 |
| ▸ | OPRD1 | P41143 | 5/20 | 0.70 |
| ▸ | OPRK1 | P41145 | 5/20 | 0.70 |
| ▸ | MRGPRX2 | Q96LB1 | 4/20 | 0.51 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | APEX1 | P27695 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL18408052 | 1.00 | OPRM1 (0.70) | OPRM1SIGMAR1OPRD1OPRK1MRGPRX2 | |
| SCHEMBL1206232 | 1.00 | OPRM1 (0.70) | OPRM1SIGMAR1OPRD1OPRK1MRGPRX2 | |
| SCHEMBL11710419 | 0.82 | SIGMAR1 (1.00) | OPRM1SIGMAR1OPRD1OPRK1MRGPRX2 | |
| SCHEMBL13589886 | 0.82 | SIGMAR1 (1.00) | OPRM1SIGMAR1OPRD1OPRK1MRGPRX2 | |
| SCHEMBL13014950 | 0.82 | SIGMAR1 (1.00) | OPRM1SIGMAR1OPRD1OPRK1MRGPRX2 | |
| SCHEMBL972352 | 0.82 | SIGMAR1 (1.00) | OPRM1SIGMAR1OPRD1OPRK1MRGPRX2 | |
| SCHEMBL1299748 | 0.82 | SIGMAR1 (1.00) | OPRM1SIGMAR1OPRD1OPRK1MRGPRX2 | |
| SCHEMBL14619144 | 0.82 | SIGMAR1 (1.00) | OPRM1SIGMAR1OPRD1OPRK1MRGPRX2 | |
| SCHEMBL11487059 | 0.80 | OPRD1 (0.71) | OPRM1SIGMAR1OPRD1OPRK1MRGPRX2 | |
| SCHEMBL12894697 | 0.78 | OPRM1 (0.68) | OPRM1SIGMAR1OPRD1OPRK1MRGPRX2 |
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-2220048-A2 | ARYL- AND HETEROARYLCARBONYL DERIVATIVES OF BENZOMORPHANES AND RELATED SCAFFOLDS, MEDICAMENTS CONTAINING SUCH COMPOUNDS AND THEIR USE | Boehringer Ingelheim International GmbH (DE) | 2010-08-25 | — | — | EP | disclosed |
| WO-2009063061-A2 | ARYL- AND HETEROARYLCARBONYL DERIVATIVES OF BENZOMORPHANES AND RELATED SCAFFOLDS, MEDICAMENTS CONTAINING SUCH COMPOUNDS AND THEIR USE | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-05-22 | — | — | WO | disclosed |