Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 4/20 | 0.54 |
| ▸ | ADH1A | P07327 | 4/20 | 0.54 |
| ▸ | ADH1C | P00326 | 3/20 | 0.54 |
| ▸ | ADH4 | P08319 | 1/20 | 0.54 |
| ▸ | ADH7 | P40394 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL3939409 | 0.74 | ADH1B (0.52) | ADH1BADH1AADH1CADH4ADH7 | |
| SCHEMBL28310284 | 0.73 | ADH1B (0.50) | ADH1BADH1AADH1CADH4ADH7 | |
| SCHEMBL28875318 | 0.72 | ADH1B (0.48) | ADH1BADH1AADH1CADH4ADH7 | |
| SCHEMBL2112448 | 0.71 | ADH1B (1.00) | ADH1BADH1AADH1CADH4ADH7 | |
| Cyclohexylformamide SCHEMBL28496813 | 0.71 | ADH1B (1.00) | ADH1BADH1AADH1CADH4ADH7 | |
| SCHEMBL22988657 | 0.71 | ADH1B (1.00) | ADH1BADH1AADH1CADH4ADH7 | |
| SCHEMBL9206597 | 0.71 | ADH1B (1.00) | ADH1BADH1AADH1CADH4ADH7 | |
| SCHEMBL645299 | 0.71 | ADH1B (1.00) | ADH1BADH1AADH1CADH4ADH7 | |
| SCHEMBL245391 | 0.71 | ADH1B (1.00) | ADH1BADH1AADH1CADH4ADH7 | |
| Cyclohexylformamide SCHEMBL26146 | 0.71 | — | — |
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-1888565-B1 | 2, 6-DI (HETERO) ARYL -4-AMIDO-PYRIMIDINES AS ADENOSINE RECEPTOR ANTAGONISTS | ALMIRALL SA (ES) | 2011-03-23 | — | — | EP | disclosed |