Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 14/20 | 0.51 |
| ▸ | CA1 | P00915 | 13/20 | 0.51 |
| ▸ | CA12 | O43570 | 9/20 | 0.51 |
| ▸ | CA9 | Q16790 | 12/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | CA7 | P43166 | 6/20 | 0.42 |
| ▸ | CA5A | P35218 | 5/20 | 0.42 |
| ▸ | CA5B | Q9Y2D0 | 5/20 | 0.42 |
| ▸ | CA6 | P23280 | 3/20 | 0.42 |
| ▸ | CA4 | P22748 | 3/20 | 0.42 |
| ▸ | CA3 | P07451 | 2/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.42 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.42 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.42 |
| ▸ | DKK1 | O94907 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL12811256 | 0.77 | C1R (0.45) | CA2CA1CA12CA9MEN1 | |
| SCHEMBL29960226 | 0.74 | ALDH1A1 (0.50) | CA2CA1CA12CA9MEN1 | |
| SCHEMBL330045 | 0.70 | CA2 (0.78) | CA2CA1CA12CA9MEN1 | |
| SCHEMBL694762 | 0.70 | C1R (0.38) | — | |
| SCHEMBL13242579 | 0.69 | CA2 (1.00) | CA2CA1CA12CA9MEN1 | |
| SCHEMBL29283437 | 0.67 | CA2 (0.67) | CA2CA1CA12CA9MEN1 | |
| Sulfanilamide SCHEMBL28291652 | 0.67 | CA2 (0.59) | CA2CA1CA12CA9CA7 | |
| SCHEMBL6726371 | 0.67 | CA2 (0.62) | CA2CA1CA12CA9MEN1 | |
| SCHEMBL28457861 | 0.67 | CA2 (0.59) | CA2CA1CA12CA9MEN1 | |
| SCHEMBL25033772 | 0.66 | CA2 (0.64) | CA2CA1CA12CA9MEN1 |
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-109748870-A | The preparation method of indenoisoquinoline derivative | 姚清发 | 2019-05-14 | — | — | CN | disclosed |