Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 15/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | CCR5 | P51681 | 1/20 | 0.41 |
| ▸ | POLQ | O75417 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8195719 | 1.00 | TACR1 (0.54) | TACR1CYP2D6OPRK1CCR5POLQ | |
| SCHEMBL8436169 | 0.87 | TACR1 (0.51) | TACR1CYP2D6OPRK1CCR5 | |
| SCHEMBL6526246 | 0.82 | OPRK1 (0.49) | TACR1CYP2D6OPRK1 | |
| SCHEMBL7646549 | 0.79 | OPRK1 (0.66) | CYP2D6OPRK1 | |
| SCHEMBL6350906 | 0.79 | OPRK1 (0.66) | CYP2D6OPRK1 | |
| SCHEMBL7168125 | 0.79 | OPRK1 (0.66) | CYP2D6OPRK1 | |
| SCHEMBL8438187 | 0.76 | OPRK1 (0.52) | TACR1CYP2D6OPRK1CCR5 | |
| SCHEMBL8433573 | 0.74 | SIGMAR1 (0.47) | TACR1CYP2D6OPRK1CCR5 | |
| SCHEMBL6481037 | 0.73 | OPRK1 (0.67) | TACR1OPRK1CCR5 | |
| SCHEMBL8670577 | 0.73 | CCR5 (0.54) | TACR1CYP2D6OPRK1CCR5 |
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-5688955-A | ANALGESICS | ADOLOR CORPORATION (US) | 1997-11-18 | — | — | US | disclosed |