Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | CRHBP | P24387 | 1/20 | 0.32 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.31 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5946432 | 0.72 | CYP3A4 (0.40) | CYP3A4ALDH1A1HPGDHSD17B10CRHBP | |
| SCHEMBL10457878 | 0.70 | HSD17B10 (0.46) | CYP3A4ALDH1A1HPGDHSD17B10CRHBP | |
| SCHEMBL16964722 | 0.70 | ADORA2A (0.34) | CYP3A4ALDH1A1HPGDHSD17B10TSHR | |
| SCHEMBL7111689 | 0.68 | ALDH1A1 (0.37) | CYP3A4ALDH1A1HPGDHSD17B10CRHBP | |
| SCHEMBL28166855 | 0.65 | — | — | |
| SCHEMBL10669992 | 0.65 | CYP3A4 (0.33) | CYP3A4ALDH1A1TSHR | |
| SCHEMBL28158622 | 0.65 | HSP90AA1 (0.33) | HSP90AA1HSP90AB1 | |
| SCHEMBL28251786 | 0.65 | — | — | |
| SCHEMBL16618505 | 0.65 | — | — | |
| SCHEMBL30872394 | 0.64 | GLP1R (0.41) | CYP3A4ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106279012-B | A kind of preparation method of 3,4,6- trichloropyridine -2- formic acid and its ester | 利尔化学股份有限公司 | 2019-04-09 | — | — | CN | disclosed |
| CN-106279012-A | A kind of 3,4,6-trichloropyridine-2-formic acid and the preparation method of ester thereof | 利尔化学股份有限公司 | 2017-01-04 | — | — | CN | disclosed |
| CN-106146393-A | Prepare 3,4,6-trichloropyridine-2-formic acid and the method for corresponding esters thereof | 利尔化学股份有限公司 | 2016-11-23 | — | — | CN | disclosed |