Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL7552485 | 0.87 | ALDH1A1 (0.35) | OPRD1OPRM1CA12CA1CA2 | |
| SCHEMBL13055040 | 0.87 | ALDH1A1 (0.35) | OPRD1OPRM1CA12CA1CA2 | |
| SCHEMBL7584467 | 0.87 | OPRM1 (0.34) | OPRM1 | |
| SCHEMBL7583861 | 0.83 | KMT2A (0.32) | — | |
| SCHEMBL7579536 | 0.82 | KMT2A (0.32) | — | |
| SCHEMBL7582108 | 0.81 | ADRA1A (0.34) | CYP2D6 | |
| SCHEMBL7589926 | 0.79 | NR1H3 (0.30) | — | |
| SCHEMBL18294767 | 0.77 | RORC (0.31) | — | |
| SCHEMBL7548572 | 0.76 | ALDH1A1 (0.40) | CYP2D6 | |
| SCHEMBL7548240 | 0.76 | BACE1 (0.35) | — |
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 |