Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 12/20 | 0.40 |
| ▸ | CA1 | P00915 | 11/20 | 0.40 |
| ▸ | CISD1 | Q9NZ45 | 4/20 | 0.40 |
| ▸ | CA12 | O43570 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | CA3 | P07451 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA6 | P23280 | 1/20 | 0.40 |
| ▸ | CA5A | P35218 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL574554 | 0.86 | CISD1 (0.43) | KMT2ASMN1; SMN2PKMALDH1A1CYP1A2 | |
| SCHEMBL574056 | 0.83 | PKM (0.45) | KMT2ASMN1; SMN2PKMALDH1A1CYP1A2 | |
| SCHEMBL574683 | 0.77 | ALDH1A1 (0.60) | KMT2ASMN1; SMN2PKMALDH1A1HCAR3 | |
| SCHEMBL9042101 | 0.76 | CA1 (0.56) | PKMALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL9737103 | 0.76 | CA2 (0.39) | KMT2ASMN1; SMN2PKMALDH1A1CA2 | |
| SCHEMBL9738547 | 0.76 | CA2 (0.39) | KMT2ASMN1; SMN2PKMALDH1A1CA2 | |
| SCHEMBL574173 | 0.75 | CA2 (0.47) | PKMALDH1A1CA2CA1CISD1 | |
| SCHEMBL2880823 | 0.74 | CDC25B (0.47) | PKMALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL11756625 | 0.74 | CA1 (0.47) | PKMALDH1A1CYP1A2CYP2D6CYP2C19 | |
| Bromide SCHEMBL10829371 | 0.73 | CA1 (0.42) | ALDH1A1CYP1A2CYP2D6CYP2C19CA2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2598478-A2 | ARYLSULFONAMIDE DERIVATIVES, COMPOSITIONS, AND METHODS OF USE | Neurotherapeutics Pharma, Inc. (US) | 2013-06-05 | — | — | EP | disclosed |
| WO-2012018635-A2 | ARYLSULFONAMIDE DERIVATIVES, COMPOSITIONS, AND METHODS OF USE | NEUROTHERAPEUTICS PHARMA, INC. (US) | 2012-02-09 | — | — | WO | disclosed |
| WO-2012018635-A2 | ARYLSULFONAMIDE DERIVATIVES, COMPOSITIONS, AND METHODS OF USE | NEUROTHERAPEUTICS PHARMA, INC. (US) | 2012-02-09 | — | — | WO | disclosed |