Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.35 |
| ▸ | SNCA | P37840 | 1/20 | 0.32 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.32 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.32 |
| ▸ | ITGAL | P20701 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | BRD2 | P25440 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 3/20 | 0.31 |
| ▸ | HTR1A | P08908 | 3/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.31 |
| ▸ | DRD1 | P21728 | 2/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9759772 | 1.00 | CYP1A2 (0.35) | CYP1A2CYP2D6CYP2C19SNCAITGB2 | |
| SCHEMBL9759048 | 0.87 | ACHE (0.41) | CYP1A2CYP2D6CYP2C19LMNAHTR1A | |
| SCHEMBL9331892 | 0.87 | ACHE (0.41) | CYP1A2CYP2D6CYP2C19LMNAHTR1A | |
| SCHEMBL9759102 | 0.84 | HRH3 (0.35) | CYP1A2CYP2D6CYP2C19SNCABRD4 | |
| SCHEMBL9759105 | 0.84 | HRH3 (0.35) | CYP1A2CYP2D6CYP2C19SNCABRD4 | |
| SCHEMBL9759290 | 0.83 | SNCA (0.32) | CYP1A2CYP2D6CYP2C19SNCABRD4 | |
| SCHEMBL9759293 | 0.83 | SNCA (0.32) | CYP1A2CYP2D6CYP2C19SNCABRD4 | |
| SCHEMBL9784839 | 0.82 | BCHE (0.39) | CYP1A2CYP2D6CYP2C19LMNAHTR1A | |
| SCHEMBL9759191 | 0.80 | HTR1A (0.36) | CYP1A2CYP2D6CYP2C19BRD4BRD2 | |
| SCHEMBL9759188 | 0.80 | HTR1A (0.36) | CYP1A2CYP2D6CYP2C19BRD4BRD2 |
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-4985419-A | Analgesics, Diuretics | RHONE-POULENC SANTE (FR) | 1991-01-15 | — | — | US | disclosed |