Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 6/20 | 0.35 |
| ▸ | RARB | P10826 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8748661 | 0.97 | LTA4H (0.35) | TP53TSHRPDK2LTA4HPLA2G4B | |
| SCHEMBL8748420 | 0.95 | PDE5A (0.35) | PDK2LTA4HCYP1A2CYP19A1CYP2C9 | |
| SCHEMBL8748701 | 0.94 | PDE5A (0.34) | PDK2LTA4HCYP1A2CYP19A1CYP2C9 | |
| SCHEMBL8748557 | 0.91 | PDE5A (0.33) | PDK2LTA4HCYP1A2CYP19A1CYP2C9 | |
| SCHEMBL8748989 | 0.91 | PDK2 (0.33) | PDK2LTA4HCYP1A2CYP19A1CYP2C9 | |
| SCHEMBL8749096 | 0.87 | PDE5A (0.34) | PDK2LTA4HCYP1A2CYP19A1CYP2C9 | |
| SCHEMBL8748426 | 0.84 | RARB (0.36) | TP53TSHRPDK2LTA4HPLA2G4B | |
| SCHEMBL8748871 | 0.84 | RARB (0.36) | TP53TSHRPDK2LTA4HPLA2G4B | |
| SCHEMBL8748687 | 0.84 | PPARG (0.36) | PDK2LTA4HCYP1A2CYP19A1CYP2C9 | |
| SCHEMBL8748384 | 0.84 | RARB (0.36) | TP53TSHRPDK2LTA4HPLA2G4B |
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 |
|---|---|---|---|---|---|---|---|
| EP-0754685-A2 | Derivatives from alkoxyalkoxy substituted nitrogen containing hetero rings | Rolic AG (CH) | 1997-01-22 | — | — | EP | disclosed |