Known targets — ChEMBL curated mechanism
SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9A
The experimentally established mechanism targets of Rufinamide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA5A | P35218 | 1/20 | 1.00 |
| ▸ | KLKB1 | P03952 | 2/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | SCD | O00767 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | KDM1A | O60341 | 1/20 | 0.41 |
| ▸ | GRM2 | Q14416 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | PRSS12 | P56730 | 1/20 | 0.39 |
| ▸ | TGM2 | P21980 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.38 |
| ▸ | MARK4 | Q96L34 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Rufinamide SCHEMBL230448 | 1.00 | CA5A (1.00) | CA5AKLKB1CYP2C19SCDALDH1A1 | |
| Rufinamide SCHEMBL17372728 | 0.99 | CA5A (0.97) | CA5AKLKB1CYP2C19SCDALDH1A1 | |
| Rufinamide SCHEMBL2594153 | 0.93 | CA5A (0.87) | CA5AKLKB1CYP2C19SCDALDH1A1 | |
| SCHEMBL9857399 | 0.91 | CA5A (0.82) | CA5AKLKB1CYP2C19SCDALDH1A1 | |
| SCHEMBL15699133 | 0.91 | CA5A (0.82) | CA5AKLKB1CYP2C19SCDALDH1A1 | |
| SCHEMBL460913 | 0.87 | CA5A (0.76) | CA5AKLKB1CYP2C19ALDH1A1LMNA | |
| SCHEMBL15838652 | 0.86 | CA5A (0.75) | CA5AKLKB1CYP2C19ALDH1A1LMNA | |
| SCHEMBL6738882 | 0.85 | CA5A (0.74) | CA5AKLKB1CYP2C19ALDH1A1LMNA | |
| SCHEMBL460954 | 0.85 | CA5A (0.74) | CA5AKLKB1CYP2C19ALDH1A1LMNA | |
| SCHEMBL9857834 | 0.85 | CA5A (0.73) | CA5AKLKB1CYP2C19SCDALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3675838-A1 | LYMPHATIC SYSTEM-DIRECTING LIPID PRODRUGS | Puretecch LYT, Inc. (US) | 2020-07-08 | — | — | EP | disclosed |
| WO-2019046491-A1 | LYMPHATIC SYSTEM-DIRECTING LIPID PRODRUGS | ARIYA THERAPEUTICS, INC. (US) | 2019-03-07 | — | — | WO | disclosed |