Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 1/20 | 0.36 |
| ▸ | ADH1C | P00326 | 1/20 | 0.36 |
| ▸ | ADH1A | P07327 | 1/20 | 0.36 |
| ▸ | ADH7 | P40394 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA3 | P07451 | 1/20 | 0.34 |
| ▸ | CA4 | P22748 | 1/20 | 0.34 |
| ▸ | CA6 | P23280 | 1/20 | 0.34 |
| ▸ | CA5A | P35218 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20204555 | 0.71 | ADH1B (0.47) | ADH1BADH1CADH1AADH7MAPT | |
| SCHEMBL20204557 | 0.70 | ADH1B (0.33) | ADH1BADH1CADH1AADH7MAPT | |
| SCHEMBL21065720 | 0.69 | ADH1B (0.47) | ADH1BADH1CADH1AADH7MAPT | |
| SCHEMBL21095759 | 0.67 | ADH1B (0.44) | ADH1BADH1CADH1AADH7MAPT | |
| SCHEMBL20204574 | 0.67 | MAPT (0.52) | MAPTKMT2AMEN1ALDH1A1SMN1; SMN2 | |
| SCHEMBL22680702 | 0.66 | CA1 (0.40) | ADH1BADH1CADH1AADH7MAPT | |
| SCHEMBL22702133 | 0.65 | ADH1B (0.46) | ADH1BADH1CADH1AADH7MAPT | |
| SCHEMBL627479 | 0.65 | ADH1B (0.54) | ADH1BADH1CADH1AADH7MAPT | |
| SCHEMBL6467025 | 0.65 | ADH1B (0.48) | ADH1BADH1CADH1AADH7MAPT | |
| SCHEMBL21095906 | 0.64 | ADH1B (0.44) | ADH1BADH1CADH1AADH7MAPT |
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-2018096510-A1 | HETEROARYLPHENOXY BENZAMIDE KAPPA OPIOID LIGANDS | PFIZER INC. (US) | 2018-05-31 | — | — | WO | disclosed |