Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 4/20 | 0.36 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | THRA | P10827 | 2/20 | 0.34 |
| ▸ | THRB | P10828 | 2/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.34 |
| ▸ | LTA4H | P09960 | 2/20 | 0.33 |
| ▸ | NAAA | Q02083 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | BAX | Q07812 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8010744 | 0.99 | OPRK1 (0.36) | OPRK1ESR1MGLLKDM4EALDH1A1 | |
| SCHEMBL7587048 | 0.91 | ESR1 (0.44) | OPRK1ESR1MGLLKDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL8011710 | 0.90 | ESR1 (0.43) | OPRK1ESR1MGLLKDM4EALDH1A1 | |
| SCHEMBL7585672 | 0.85 | OPRK1 (0.46) | OPRK1ESR1 | |
| SCHEMBL7584106 | 0.85 | ESR1 (0.49) | OPRK1ESR1MGLLKDM4EALDH1A1 | |
| SCHEMBL7584146 | 0.85 | PBRM1 (0.40) | OPRK1ESR1 | |
| Hydrochloric Acid SCHEMBL8014814 | 0.84 | ESR1 (0.48) | OPRK1ESR1MGLLKDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL8012131 | 0.84 | OPRK1 (0.45) | OPRK1ESR1 | |
| Hydrochloric Acid SCHEMBL8017505 | 0.84 | PBRM1 (0.39) | OPRK1ESR1 | |
| SCHEMBL7591741 | 0.82 | MTNR1A (0.44) | OPRK1KDM4EALDH1A1SLC6A2SLC6A4 |
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-0864559-B1 | Substituted amino compounds and their use as analgesic active substances | GRUENENTHAL GMBH (DE) | 2002-06-05 | — | — | EP | disclosed |
| EP-0864559-A1 | Substituted amino compounds and their use as analgesic active substances | Grünenthal GmbH (DE) | 1998-09-16 | — | — | EP | disclosed |