Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 5/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.32 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.32 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.32 |
| ▸ | CCR1 | P32246 | 2/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7555608 | 0.89 | CCR1 (0.36) | OPRM1ADRA1AADRA1DADRA1BCCR1 | |
| SCHEMBL13053890 | 0.89 | CCR1 (0.36) | OPRM1ADRA1AADRA1DADRA1BCCR1 | |
| SCHEMBL7583944 | 0.87 | OPRD1 (0.37) | OPRM1 | |
| SCHEMBL7582108 | 0.81 | ADRA1A (0.34) | ADRA1AADRA1DADRA1B | |
| SCHEMBL7589393 | 0.78 | — | — | |
| SCHEMBL13081542 | 0.78 | STK4 (0.38) | OPRM1ADRA1AADRA1DADRA1B | |
| SCHEMBL14106069 | 0.78 | STK4 (0.33) | OPRM1ADRA1AADRA1DADRA1B | |
| SCHEMBL7552485 | 0.75 | ALDH1A1 (0.35) | OPRM1 | |
| SCHEMBL13055040 | 0.75 | ALDH1A1 (0.35) | OPRM1 | |
| SCHEMBL7583861 | 0.75 | KMT2A (0.32) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8183252-B2 | Heterocyclic aspartyl protease inhibitors | SCHERING CORPORATION (US) | 2012-05-22 | — | — | US | disclosed |