Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLA | P06280 | 2/20 | 0.58 |
| ▸ | GAA | P10253 | 2/20 | 0.58 |
| ▸ | STS | P08842 | 1/20 | 0.58 |
| ▸ | MAOB | P27338 | 3/20 | 0.53 |
| ▸ | CA1 | P00915 | 13/20 | 0.50 |
| ▸ | CA12 | O43570 | 12/20 | 0.50 |
| ▸ | CA9 | Q16790 | 11/20 | 0.50 |
| ▸ | CA7 | P43166 | 6/20 | 0.49 |
| ▸ | CA4 | P22748 | 6/20 | 0.49 |
| ▸ | CA6 | P23280 | 5/20 | 0.49 |
| ▸ | CA14 | Q9ULX7 | 5/20 | 0.49 |
| ▸ | CA5A | P35218 | 4/20 | 0.49 |
| ▸ | CA3 | P07451 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | CA5B | Q9Y2D0 | 4/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Hydrogen Sulfide SCHEMBL6878856 | 0.85 | GLA (0.66) | GLAGAASTSMAOBCA1 | |
| SCHEMBL9432106 | 0.83 | GLA (0.68) | GLAGAASTSMAOBCA1 | |
| Hydrogen Sulfide SCHEMBL6878894 | 0.83 | ALDH1A1 (0.44) | GLAGAASTSMAOBCA1 | |
| SCHEMBL3370959 | 0.79 | GLA (0.39) | GLAGAASTSMAOBCA1 | |
| SCHEMBL575913 | 0.78 | CA2 (0.51) | STSCA1CA9CA2 | |
| SCHEMBL3371461 | 0.78 | GLA (0.39) | GLAGAASTSMAOBCA1 | |
| SCHEMBL17318081 | 0.77 | GLA (0.71) | GLAGAASTSMAOBCA1 | |
| SCHEMBL31299567 | 0.76 | CA1 (0.53) | GAACA1CA9CYP1A2CA2 | |
| SCHEMBL3519467 | 0.75 | MAOB (0.46) | GLAGAASTSMAOBCA1 | |
| SCHEMBL31440230 | 0.75 | CA1 (0.53) | GAACA1CA9CYP1A2CA2 |
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 |