Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.36 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 6/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | SCN1A | P35498 | 1/20 | 0.33 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.33 |
| ▸ | SCN3A | Q9NY46 | 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 | |
|---|---|---|---|---|
| SCHEMBL13199857 | 0.85 | CYP4F2 (0.46) | CYP2D6CYP4F2CYP4A11CYP2C19 | |
| SCHEMBL379072 | 0.83 | OPRM1 (0.48) | OPRM1KCNH2SLC22A1SLC6A4ADRA1A | |
| SCHEMBL13715140 | 0.82 | CYP4F2 (0.47) | CYP2D6CYP4F2CYP4A11CYP2C19 | |
| SCHEMBL16508898 | 0.80 | OPRM1 (0.40) | CYP4F2CYP4A11OPRM1KCNH2SLC22A1 | |
| SCHEMBL19483314 | 0.79 | CYP2C19 (0.32) | CYP2C19 | |
| SCHEMBL89520 | 0.77 | PKM (0.47) | CYP2D6CYP4F2CYP4A11 | |
| SCHEMBL22014531 | 0.77 | CYP4F2 (0.44) | CYP4F2CYP4A11OPRM1KCNH2SLC22A1 | |
| SCHEMBL12540731 | 0.76 | MAPK1 (0.46) | CYP4F2CYP4A11OPRM1KCNH2SLC22A1 | |
| SCHEMBL22014295 | 0.73 | SCN1A (0.36) | CYP2D6OPRM1KCNH2SLC22A1SLC6A4 | |
| SCHEMBL20446734 | 0.72 | MEN1 (0.34) | CYP2D6CYP4F2CYP4A11CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020099885-A1 | HETEROCYCLIC SPIRO-COMPOUNDS AS AM2 RECEPTOR INHIBITORS | THE UNIVERSITY OF SHEFFIELD (GB) | 2020-05-22 | — | — | WO | disclosed |