Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | SCN4A | P35499 | 8/20 | 0.48 |
| ▸ | SCN8A | Q9UQD0 | 5/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | SCN1A | P35498 | 2/20 | 0.48 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.48 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.48 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.48 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.48 |
| ▸ | GBA1 | P04062 | 1/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL18727141 | 0.81 | SCN4A (0.52) | ALDH1A1SCN4ASCN8ALMNASCN1A | |
| SCHEMBL1991553 | 0.79 | ALDH1A1 (0.52) | ALDH1A1SCN4ASCN8ALMNASCN1A | |
| SCHEMBL2094083 | 0.78 | SCN4A (0.54) | ALDH1A1SCN4ASCN8ALMNASCN1A | |
| SCHEMBL9201467 | 0.77 | SCN4A (0.55) | ALDH1A1SCN4ASCN8ALMNASCN1A | |
| SCHEMBL5824885 | 0.77 | ALDH1A1 (0.50) | ALDH1A1SCN4ASCN8ALMNASCN1A | |
| SCHEMBL64093 | 0.77 | ALDH1A1 (0.50) | ALDH1A1SCN4ASCN8ALMNASCN1A | |
| Ammonia Solution, Strong SCHEMBL8858388 | 0.77 | ALDH1A1 (0.50) | ALDH1A1SCN4ASCN8ALMNASCN1A | |
| SCHEMBL4382775 | 0.77 | ALDH1A1 (0.55) | ALDH1A1SCN4ASCN8ALMNASCN1A | |
| SCHEMBL6373909 | 0.77 | ALDH1A1 (0.55) | ALDH1A1SCN4ASCN8ALMNASCN1A | |
| SCHEMBL515980 | 0.77 | ALDH1A1 (0.61) | ALDH1A1SCN4ASCN8ALMNASCN1A |
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-2013101911-A2 | BENZIMIDAZOLE DERIVATIVES AS SELECTIVE BLOCKERS OF PERSISTENT SODIUM CURRENT | ALLERGAN, INC. (US) | 2013-07-04 | — | — | WO | disclosed |