Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 11/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 9/20 | 0.39 |
| ▸ | MAOB | P27338 | 7/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 4/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | SNCA | P37840 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL3724472 | 0.82 | OPRK1 (0.40) | OPRK1OPRD1MAOBADRA2BADRA2C | |
| SCHEMBL11117786 | 0.76 | OPRK1 (0.48) | OPRK1OPRD1MAOBADRA2BADRA2C | |
| SCHEMBL4768349 | 0.76 | CYP1A2 (0.47) | CYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL30765143 | 0.75 | CHRNB2 (0.41) | OPRD1SLC6A2HTR2ASLC6A4SLC6A3 | |
| Iodide SCHEMBL5092821 | 0.74 | OPRK1 (0.47) | OPRK1OPRD1MAOBADRA2BADRA2C | |
| Hydrochloric Acid SCHEMBL8073423 | 0.74 | CYP1A2 (0.46) | CYP1A2CYP2D6 | |
| Bromide SCHEMBL5092308 | 0.74 | OPRK1 (0.47) | OPRK1OPRD1MAOBADRA2BADRA2C | |
| Hydrochloric Acid SCHEMBL5092786 | 0.74 | OPRK1 (0.47) | OPRK1OPRD1MAOBADRA2BADRA2C | |
| SCHEMBL28131459 | 0.73 | OPRK1 (0.46) | OPRK1OPRD1MAOBADRA2BADRA2C | |
| SCHEMBL9915838 | 0.71 | OPRK1 (0.52) | OPRK1OPRD1MAOBADRA2BADRA2C |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1968938-A1 | SUBSTITUTED PROPIOLIC ACID AMIDES AND THEIR USE FOR PRODUCING DRUGS | Grünenthal GmbH (DE) | 2008-09-17 | — | — | EP | disclosed |
| EP-1968935-A1 | SUBSTITUTED BIS(HETERO)AROMATIC N-ETHYLPROPIOLAMIDES AND USE THEREOF FOR PRODUCTION OF MEDICAMENTS | Grünenthal GmbH (DE) | 2008-09-17 | — | — | EP | disclosed |
| EP-1968963-A1 | SUBSTITUTED PROPIOLIC ACID AMIDES AND THEIR USE FOR PRODUCING ANALGESICS | Grünenthal GmbH (DE) | 2008-09-17 | — | — | EP | disclosed |
| WO-2007079957-A1 | SUBSTITUTED PROPIOLIC ACID AMIDES AND THEIR USE FOR PRODUCING DRUGS | Grünenthal GmbH (DE) | 2007-07-19 | — | — | WO | disclosed |
| WO-2007079958-A1 | SUBSTITUTED BIS(HETERO)AROMATIC N-ETHYLPROPIOLAMIDES AND USE THEREOF FOR PRODUCTION OF MEDICAMENTS | Grünenthal GmbH (DE) | 2007-07-19 | — | — | WO | disclosed |
| WO-2007079959-A1 | SUBSTITUTED PROPIOLIC ACID AMIDES AND THEIR USE FOR PRODUCING ANALGESICS | Grünenthal GmbH (DE) | 2007-07-19 | — | — | WO | disclosed |