Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | RORC | P51449 | 1/20 | 0.38 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.36 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL30285983 | 0.93 | GABRA1 (0.43) | ALDH1A1TSHRPOLBGAAGFER | |
| SCHEMBL6774835 | 0.93 | GABRA1 (0.43) | ALDH1A1TSHRPOLBGAAGFER | |
| SCHEMBL282523 | 0.77 | ALDH1A1 (0.38) | ALDH1A1TSHRPOLBGAAGFER | |
| SCHEMBL6545793 | 0.77 | ALDH1A1 (0.38) | ALDH1A1TSHRPOLBGAAGFER | |
| SCHEMBL19121870 | 0.74 | GABRA1 (0.41) | ALDH1A1TSHRPOLBGAAGABRA1 | |
| SCHEMBL19617651 | 0.74 | GABRA1 (0.37) | ALDH1A1POLBGAAGFERGABRA1 | |
| SCHEMBL29970124 | 0.74 | GABRA1 (0.37) | ALDH1A1POLBGAAGFERGABRA1 | |
| SCHEMBL8119851 | 0.73 | NFE2L2 (0.43) | ALDH1A1TSHRPOLBGAAGFER | |
| SCHEMBL13395132 | 0.72 | CYP2D6 (0.42) | ALDH1A1TSHRPOLBGAAGFER | |
| SCHEMBL739698 | 0.71 | HDAC4 (0.48) | ALDH1A1TSHRPOLBGAAGFER |
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 |
|---|---|---|---|---|---|---|---|
| CN-1630515-A | Compounds active at the glucocorticoid receptor II | KAROBIO AB (SE) | 2005-06-22 | — | — | CN | disclosed |