Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 1/20 | 0.30 |
| ▸ | ADH1C | P00326 | 1/20 | 0.30 |
| ▸ | ADH1A | P07327 | 1/20 | 0.30 |
| ▸ | CCR5 | P51681 | 1/20 | 0.30 |
| ▸ | GBA1 | P04062 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL13503192 | 0.74 | — | — | |
| SCHEMBL13397254 | 0.72 | SLC6A2 (0.37) | ADH1BADH1CADH1A | |
| SCHEMBL10036715 | 0.71 | ADH1B (0.39) | ADH1BADH1CADH1A | |
| SCHEMBL20438384 | 0.71 | ADH1B (0.39) | ADH1BADH1CADH1A | |
| SCHEMBL19754763 | 0.71 | ADH1A (0.44) | ADH1BADH1CADH1A | |
| SCHEMBL15221572 | 0.69 | ADH1A (0.48) | ADH1BADH1CADH1A | |
| SCHEMBL13503170 | 0.69 | — | — | |
| SCHEMBL13397291 | 0.67 | — | — | |
| SCHEMBL18841464 | 0.67 | ADH1A (0.52) | ADH1BADH1CADH1A | |
| SCHEMBL9551174 | 0.67 | ADH1A (0.52) | ADH1BADH1CADH1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021027943-A1 | PYRIMIDINOPYRIDAZINONE DERIVATIVE AND MEDICAL USE THEREOF | 正大天晴药业集团南京顺欣制药有限公司 | 2021-02-18 | — | — | WO | disclosed |