Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.41 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.40 |
| ▸ | LTA4H | P09960 | 2/20 | 0.39 |
| ▸ | PDE2A | O00408 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | PPARD | Q03181 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22809574 | 0.87 | SLC7A5 (0.50) | SMN1; SMN2PDK2SLC7A5LTA4HPDE2A | |
| Hydrochloric Acid SCHEMBL28350715 | 0.86 | SLC7A5 (0.49) | SMN1; SMN2PDK2SLC7A5LTA4HPDE2A | |
| Hydrochloric Acid SCHEMBL30450035 | 0.86 | SLC7A5 (0.49) | SMN1; SMN2PDK2SLC7A5LTA4HPDE2A | |
| SCHEMBL1683223 | 0.76 | SMN1; SMN2 (0.45) | SMN1; SMN2PDK2SLC7A5LTA4HTAAR1 | |
| SCHEMBL26334840 | 0.75 | PPARD (0.41) | SLC7A5FFAR1PPARGPPARD | |
| SCHEMBL18295348 | 0.74 | TAAR1 (0.47) | SMN1; SMN2PDK2LTA4HTAAR1PLA2G2A | |
| SCHEMBL25799178 | 0.74 | S1PR4 (0.40) | PDK2FFAR1PPARGPPARD | |
| SCHEMBL26334630 | 0.74 | S1PR4 (0.40) | PDK2FFAR1PPARGPPARD | |
| SCHEMBL4856586 | 0.74 | MAOB (0.54) | SMN1; SMN2PDK2LTA4HTAAR1PLA2G2A | |
| SCHEMBL22809630 | 0.73 | SLC7A5 (0.48) | SMN1; SMN2PDK2SLC7A5LTA4HTAAR1 |
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-3487839-B1 | AMIDE DERIVATIVES AS NAV1.7 AND NAV1.8 BLOCKERS | RAQUALIA PHARMA INC (JP) | 2020-12-23 | — | — | EP | disclosed |