Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 1/20 | 0.63 |
| ▸ | ADH1C | P00326 | 1/20 | 0.63 |
| ▸ | ADH1A | P07327 | 1/20 | 0.63 |
| ▸ | ADH7 | P40394 | 1/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29798082 | 0.82 | ADH1B (0.65) | ADH1BADH1CADH1AADH7KMT2A | |
| SCHEMBL8713797 | 0.82 | ADH1B (0.65) | ADH1BADH1CADH1AADH7KMT2A | |
| SCHEMBL19512775 | 0.79 | ADH1B (0.52) | ADH1BADH1CADH1AADH7KMT2A | |
| SCHEMBL8867945 | 0.78 | ADH1B (0.68) | ADH1BADH1CADH1AADH7KMT2A | |
| SCHEMBL27354 | 0.78 | ADH1B (1.00) | ADH1BADH1CADH1AADH7KMT2A | |
| SCHEMBL19415688 | 0.78 | ADH1B (0.50) | ADH1BADH1CADH1AADH7KMT2A | |
| SCHEMBL24060195 | 0.76 | ADH1B (0.58) | ADH1BADH1CADH1AADH7KMT2A | |
| Hydrochloric Acid SCHEMBL3741186 | 0.76 | ADH1B (0.95) | ADH1BADH1CADH1AADH7KMT2A | |
| SCHEMBL23009349 | 0.75 | ADH1B (0.47) | ADH1BADH1CADH1AADH7KMT2A | |
| SCHEMBL656733 | 0.74 | ADH1B (0.56) | ADH1BADH1CADH1AADH7KMT2A |
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-106518757-A | Method for synthesizing 2-halo-3-substited alkylsulfonyl pyridine and intermediate compound thereof through microwave method | 山东师范大学 | 2017-03-22 | — | — | CN | claimed |