Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | GRM4 | Q14833 | 3/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | GSK3A | P49840 | 1/20 | 0.44 |
| ▸ | GSK3B | P49841 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | BRAF | P15056 | 1/20 | 0.42 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.42 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.42 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL12019071 | 0.92 | GAA (0.48) | GAAGRM4NPC1RAB9AMAPK1 | |
| SCHEMBL14301058 | 0.85 | GRM4 (0.56) | GRM4NPC1RAB9AALDH1A1MEN1 | |
| SCHEMBL12019073 | 0.84 | CYP2A6 (0.46) | GAAGRM4NPC1RAB9AMAPK1 | |
| SCHEMBL12019074 | 0.83 | TLR8 (0.42) | GAAGRM4NPC1RAB9AMAPK1 | |
| SCHEMBL7148386 | 0.83 | GRM4 (0.55) | GRM4NPC1RAB9AMAPK1ALDH1A1 | |
| SCHEMBL12019076 | 0.82 | CYP2A6 (0.43) | GAAGRM4TLR8CYP2A6CYP2E1 | |
| SCHEMBL8208858 | 0.82 | GAA (0.50) | GAANPC1RAB9AMAPK1GSK3A | |
| SCHEMBL12004595 | 0.82 | IDO1 (0.39) | GAAGRM4NPC1RAB9AMAPK1 | |
| SCHEMBL12019075 | 0.81 | GRM4 (0.47) | GAAGRM4NPC1RAB9AMAPK1 | |
| SCHEMBL19372703 | 0.79 | CYP2A6 (0.47) | GAAGRM4NPC1RAB9AMAPK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3186229-A4 | PROCESS FOR THE PREPARATION OF 3-(3-CHLORO-1H-PYRAZOL-1-YL)PYRIDINE | Dow AgroSciences LLC (US) | 2018-01-10 | — | — | EP | disclosed |
| EP-3186229-A1 | PROCESS FOR THE PREPARATION OF 3-(3-CHLORO-1H-PYRAZOL-1-YL)PYRIDINE | Dow AgroSciences LLC (US) | 2017-07-05 | — | — | EP | disclosed |
| WO-2016018443-A1 | PROCESS FOR THE PREPARATION OF 3-(3-CHLORO-1H-PYRAZOL-1-YL)PYRIDINE | DOW AGROSCIENCES LLC (US) | 2016-02-04 | — | — | WO | disclosed |