Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN1A | P35498 | 7/20 | 0.62 |
| ▸ | SCN2A | Q99250 | 7/20 | 0.62 |
| ▸ | SCN3A | Q9NY46 | 7/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.62 |
| ▸ | TSHR | P16473 | 5/20 | 0.61 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.61 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.61 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.61 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.61 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.61 |
| ▸ | RAD52 | P43351 | 1/20 | 0.60 |
| ▸ | MAOA | P21397 | 3/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | HTR3A | P46098 | 3/20 | 0.50 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL7505992 | 0.84 | ALDH1A1 (0.55) | SCN1ASCN2ASCN3ACYP2D6CYP1A2 | |
| SCHEMBL11339945 | 0.84 | ALDH1A1 (0.62) | SCN1ASCN2ASCN3ACYP2D6CYP1A2 | |
| SCHEMBL27629621 | 0.83 | SCN1A (0.58) | SCN1ASCN2ASCN3ACYP2D6CYP1A2 | |
| Metabutoxycaine SCHEMBL25778 | 0.83 | ALDH1A1 (0.58) | SCN1ASCN2ASCN3ACYP2D6CYP1A2 | |
| Metabutoxycaine SCHEMBL1643491 | 0.82 | RAD52 (0.58) | SCN1ASCN2ASCN3ACYP2D6CYP1A2 | |
| Metabutoxycaine SCHEMBL30053144 | 0.82 | RAD52 (0.58) | SCN1ASCN2ASCN3ACYP2D6CYP1A2 | |
| Ambucaine SCHEMBL82280 | 0.81 | SCN1A (0.91) | SCN1ASCN2ASCN3ACYP2D6CYP1A2 | |
| SCHEMBL11401080 | 0.81 | SCN1A (0.67) | SCN1ASCN2ASCN3ACYP2D6CYP1A2 | |
| Ambucaine SCHEMBL1007224 | 0.81 | CYP2D6 (0.88) | SCN1ASCN2ASCN3ACYP2D6CYP1A2 | |
| SCHEMBL26696240 | 0.80 | MAPT (0.51) | CYP1A2TSHRSLC6A3CYP3A4CYP2C19 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111295369-B | Carbonic acid adducts | 炎症药物有限责任公司 | 2023-07-25 | — | — | CN | disclosed |
| EP-1725098-A2 | BENZAMIDE AND BENZOATE ANTI-HIV COMPOUNDS | Samaritan Pharmaceuticals, Inc. (US) | 2006-11-29 | — | — | EP | disclosed |
| WO-2005089453-A2 | BENZAMIDE AND BENZOATE ANTI-HIV COMPOUNDS | SAMARITAN PHARMACEUTICALS, INC. (US) | 2005-09-29 | — | — | WO | disclosed |