Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 5/20 | 0.73 |
| ▸ | CA12 | O43570 | 6/20 | 0.68 |
| ▸ | CA1 | P00915 | 4/20 | 0.68 |
| ▸ | CA9 | Q16790 | 4/20 | 0.68 |
| ▸ | GLA | P06280 | 4/20 | 0.63 |
| ▸ | GAA | P10253 | 4/20 | 0.63 |
| ▸ | STS | P08842 | 1/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | GBA1 | P04062 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | CA4 | P22748 | 3/20 | 0.54 |
| ▸ | CA5A | P35218 | 3/20 | 0.54 |
| ▸ | CA7 | P43166 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | CA6 | P23280 | 2/20 | 0.54 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.54 |
| ▸ | CA3 | P07451 | 1/20 | 0.54 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL10849811 | 0.85 | MAOB (1.00) | MAOBCA12CA1CA9GLA | |
| Hydrogen Sulfide SCHEMBL6875323 | 0.83 | MAOB (0.68) | MAOBCA12CA1CA9GLA | |
| Hydrogen Sulfide SCHEMBL6877387 | 0.83 | CA12 (0.54) | MAOBCA12CA1CA9GLA | |
| SCHEMBL8515482 | 0.81 | CA12 (1.00) | MAOBCA12CA1CA9GLA | |
| SCHEMBL3523373 | 0.78 | CA12 (0.58) | MAOBCA12CA1CA9GLA | |
| 7-Methanesulfonyloxycoumarin SCHEMBL10851014 | 0.78 | GAA (0.71) | MAOBCA12CA1CA9GLA | |
| SCHEMBL14802647 | 0.78 | GBA1 (0.65) | CA12CA1CA9GLAGAA | |
| SCHEMBL561434 | 0.78 | GLA (1.00) | MAOBCA12CA1CA9GLA | |
| SCHEMBL8794066 | 0.78 | MEN1 (0.82) | MAOBCA12GAAMAPTKMT2A | |
| SCHEMBL4126086 | 0.77 | MEN1 (0.60) | CA12CA1CA9GAAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1481973-A1 | HETEROCYCLE-BEARING ONIUM SALTS | Wako Pure Chemical Industries, Ltd. (JP) | 2004-12-01 | — | — | EP | disclosed |