Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 7/20 | 0.49 |
| ▸ | OPRD1 | P41143 | 7/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL4517317 | 0.89 | OPRM1 (0.39) | OPRM1OPRD1CYP1A2HSP90AA1HSP90AB1 | |
| SCHEMBL490453 | 0.87 | OPRD1 (0.44) | OPRM1OPRD1CYP1A2HSP90AA1HSP90AB1 | |
| SCHEMBL490111 | 0.85 | OPRD1 (0.53) | OPRM1OPRD1 | |
| SCHEMBL5096902 | 0.83 | OPRD1 (0.48) | OPRM1OPRD1CYP1A2HSP90AA1HSP90AB1 | |
| SCHEMBL489911 | 0.78 | OPRM1 (0.48) | OPRM1OPRD1 | |
| SCHEMBL3177080 | 0.77 | OPRM1 (0.45) | OPRM1OPRD1CYP1A2HSP90AA1HSP90AB1 | |
| SCHEMBL490182 | 0.76 | OPRD1 (0.40) | OPRM1OPRD1 | |
| SCHEMBL489974 | 0.76 | OPRD1 (0.45) | OPRM1OPRD1HSP90AA1HSP90AB1HPGD | |
| SCHEMBL13627455 | 0.75 | RECQL (0.33) | NPC1ALDH1A1HPGDRAB9AHSD17B10 | |
| SCHEMBL4509385 | 0.75 | OPRD1 (0.48) | OPRM1OPRD1HPGD |
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-7589104-B2 | Tricyclic-bridged piperidinyline derivatives as §-opioid modulators | JANSSEN PHARMACEUTICA NV (BE) | 2009-09-15 | — | — | US | disclosed |