Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLA | P06280 | 5/20 | 0.44 |
| ▸ | GAA | P10253 | 4/20 | 0.44 |
| ▸ | CA12 | O43570 | 12/20 | 0.41 |
| ▸ | CA9 | Q16790 | 12/20 | 0.41 |
| ▸ | CA1 | P00915 | 8/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 4/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | CASP1 | P29466 | 2/20 | 0.41 |
| ▸ | CASP7 | P55210 | 2/20 | 0.41 |
| ▸ | ERAP1 | Q9NZ08 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | STS | P08842 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Trifluoromethanesulfonic Acid SCHEMBL5114458 | 0.86 | GLA (0.50) | GLAGAACA12CA9CA1 | |
| SCHEMBL6878901 | 0.85 | GAA (0.38) | GLAGAACA12CA9CA1 | |
| SCHEMBL6869907 | 0.80 | THRB (0.44) | GLAGAACA12CA9CA1 | |
| SCHEMBL5040810 | 0.77 | CA12 (0.59) | GLAGAACA12CA9CA1 | |
| SCHEMBL6875324 | 0.76 | GLA (0.43) | GLAGAACA12CA9CA1 | |
| SCHEMBL6869582 | 0.76 | GLA (0.43) | GLAGAACA12CA9CA1 | |
| SCHEMBL6868837 | 0.76 | CYP2A6 (0.37) | CA12CA9CA1MCL1TDP1 | |
| Bromide SCHEMBL6878726 | 0.75 | CA12 (0.57) | GLAGAACA12CA9CA1 | |
| SCHEMBL6869309 | 0.75 | GLA (0.47) | GLAGAACA12CA9CA1 | |
| Biphenyl SCHEMBL27611650 | 0.74 | PGR (0.44) | GLAGAACA12CA9CA1 |
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 |