Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC1 | P19801 | 6/20 | 0.61 |
| ▸ | AOC3 | Q16853 | 6/20 | 0.61 |
| ▸ | CYP2E1 | P05181 | 5/20 | 0.51 |
| ▸ | CYP2C8 | P10632 | 5/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.51 |
| ▸ | CYP2A6 | P11509 | 5/20 | 0.51 |
| ▸ | CYP2B6 | P20813 | 5/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KDM6B | O15054 | 1/20 | 0.38 |
| ▸ | KDM4A | O75164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL294034 | 0.86 | AOC1 (0.55) | AOC1AOC3CYP2E1CYP2C8CYP2D6 | |
| SCHEMBL5744881 | 0.85 | AOC1 (0.53) | AOC1AOC3CYP2E1CYP2C8CYP2D6 | |
| SCHEMBL5750088 | 0.85 | AOC1 (0.53) | AOC1AOC3CYP2E1CYP2C8CYP2D6 | |
| SCHEMBL5749554 | 0.85 | AOC1 (0.53) | AOC1AOC3CYP2E1CYP2C8CYP2D6 | |
| SCHEMBL30210557 | 0.85 | — | — | |
| SCHEMBL5748797 | 0.85 | — | — | |
| Ammonia Solution, Strong SCHEMBL28661009 | 0.83 | AOC1 (0.52) | AOC1AOC3CYP2E1CYP2C8CYP2D6 | |
| SCHEMBL18716208 | 0.83 | CYP2E1 (0.47) | AOC1AOC3CYP2E1CYP2C8CYP2D6 | |
| Ammonia Solution, Strong SCHEMBL3984283 | 0.83 | AOC1 (0.65) | AOC1AOC3CYP2E1CYP2C8CYP2D6 | |
| SCHEMBL10954433 | 0.80 | CYP2E1 (0.51) | AOC1AOC3CYP2E1CYP2C8CYP2D6 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0682655-B1 | METHOD FOR PREPARING 3-AMINO-2-CHLORO-4-ALKYLPYRIDINE OR -4-CYCLOALKYLPYRIDINES | BOEHRINGER INGELHEIM PHARMA (DE) | 2000-05-03 | — | — | EP | disclosed |
| US-5686618-A | Method for preparing 3-amino-2-chloro-4-alkylpyridine or-4-arylpyridine | BOEHRINGER INGELHEIM KG (DE) | 1997-11-11 | — | — | US | disclosed |
| EP-0682655-A1 | METHOD FOR PREPARING 3-AMINO-2-CHLORO-4-ALKYLPYRIDINE OR -4-ARYLPYRIDINE | BOEHRINGER INGELHEIM KG (DE) | 1995-11-22 | — | — | EP | disclosed |
| WO-1995015314-A1 | METHOD FOR PREPARING 3-AMINO-2-CHLORO-4-ALKYLPYRIDINE OR -4-ARYLPYRIDINE | BOEHRINGER INGELHEIM KG (DE) | 1995-06-08 | — | — | WO | disclosed |