Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | SLC6A12 | P48065 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.42 |
| ▸ | OXTR | P30559 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5506035 | 0.93 | KDM4E (0.47) | KDM4EALDH1A1SLC6A12SIGMAR1OXTR | |
| SCHEMBL5507813 | 0.88 | CHRM4 (0.43) | KDM4EALDH1A1SLC6A12 | |
| SCHEMBL5118069 | 0.87 | ALDH1A1 (0.47) | KDM4EALDH1A1SLC6A12SIGMAR1 | |
| SCHEMBL5126292 | 0.82 | KDM4E (0.49) | KDM4EALDH1A1SLC6A12SIGMAR1OXTR | |
| SCHEMBL5111526 | 0.79 | KDM4E (0.46) | KDM4EALDH1A1SLC6A12SIGMAR1OXTR | |
| SCHEMBL5115898 | 0.78 | OPRD1 (0.47) | KDM4EALDH1A1 | |
| SCHEMBL5503754 | 0.78 | OPRM1 (0.45) | ALDH1A1SLC6A12SIGMAR1 | |
| SCHEMBL14051771 | 0.76 | MEN1 (0.46) | KDM4EALDH1A1 | |
| SCHEMBL5119452 | 0.75 | CHRM4 (0.48) | KDM4EALDH1A1SLC6A12 | |
| SCHEMBL14051772 | 0.75 | DRD2 (0.43) | KDM4EALDH1A1OXTR |
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-1846400-A2 | TRICYCLIC DELTA-OPIOID MODULATORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2007-10-24 | — | — | EP | disclosed |
| WO-2006074388-A2 | TRICYCLIC δ-OPIOID MODULATORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2006-07-13 | — | — | WO | disclosed |