Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLO1 | Q04760 | 2/20 | 0.63 |
| ▸ | CA1 | P00915 | 2/20 | 0.54 |
| ▸ | CA2 | P00918 | 2/20 | 0.54 |
| ▸ | CA4 | P22748 | 1/20 | 0.54 |
| ▸ | CA7 | P43166 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | MAOB | P27338 | 1/20 | 0.52 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.51 |
| ▸ | RECQL | P46063 | 1/20 | 0.51 |
| ▸ | FBP1 | P09467 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | CCR6 | P51684 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL10989985 | 0.91 | GLO1 (0.61) | GLO1CA1CA2CA4CA7 | |
| SCHEMBL11524284 | 0.88 | NFE2L2 (0.58) | GLO1CA1CA2CA4CA7 | |
| SCHEMBL11564387 | 0.82 | AKR1C3 (0.48) | CA1CA2CA4CA7ALDH1A1 | |
| SCHEMBL11564392 | 0.82 | AKR1C3 (0.48) | CA1CA2CA4CA7ALDH1A1 | |
| SCHEMBL10983993 | 0.82 | GLO1 (0.66) | GLO1CA1CA2CA4CA7 | |
| SCHEMBL10983080 | 0.81 | GLO1 (0.59) | GLO1CA1CA2CA4CA7 | |
| SCHEMBL29289251 | 0.79 | ALDH1A1 (0.60) | GLO1MAPTMAOBNFE2L2ALDH1A1 | |
| SCHEMBL10896757 | 0.79 | GLO1 (0.61) | GLO1CA1CA2CA4CA7 | |
| SCHEMBL29289250 | 0.79 | ALDH1A1 (0.60) | GLO1MAPTMAOBNFE2L2ALDH1A1 | |
| SCHEMBL10896764 | 0.79 | GLO1 (0.61) | GLO1CA1CA2CA4CA7 |
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-0001769-A1 | Sulfur-containing esters of 1,4-dihydropyridine carboxylic acids, their preparation and pharmaceutical use | BAYER AG (DE) | 1979-05-16 | — | — | EP | disclosed |