Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | ACLY | P53396 | 6/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL574219 | 1.00 | HPGD (0.45) | HPGDALDH1A1KDM4EGAAPKM | |
| SCHEMBL10996368 | 0.90 | GAA (0.43) | HPGDALDH1A1KDM4EGAAPKM | |
| SCHEMBL10996371 | 0.90 | GAA (0.43) | HPGDALDH1A1KDM4EGAAPKM | |
| SCHEMBL21436402 | 0.86 | KDM4E (0.37) | HPGDALDH1A1KDM4EGAAPKM | |
| SCHEMBL11197357 | 0.86 | KDM4E (0.37) | HPGDALDH1A1KDM4EGAAPKM | |
| SCHEMBL10998834 | 0.83 | KDM4E (0.42) | HPGDALDH1A1KDM4EGAAPKM | |
| SCHEMBL573280 | 0.83 | VCAM1 (0.45) | HPGDALDH1A1KDM4EGAAACLY | |
| SCHEMBL573281 | 0.83 | VCAM1 (0.45) | HPGDALDH1A1KDM4EGAAACLY | |
| SCHEMBL573731 | 0.83 | HPGD (0.43) | HPGDALDH1A1KDM4EGAAPKM | |
| SCHEMBL574175 | 0.83 | HPGD (0.43) | HPGDALDH1A1KDM4EGAAPKM |
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-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 |