Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL8995866 | 0.87 | MAPT (0.58) | CYP1A2MAPTKMT2ACYP2D6ALDH1A1 | |
| Acetic Acid SCHEMBL3621605 | 0.85 | MAPT (0.56) | CYP1A2MAPTKMT2ACYP2D6ALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL1515530 | 0.82 | SLC22A12 (0.43) | MAPTHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL6145 | 0.82 | KCNN4 (0.58) | MAPTKMT2AALDH1A1TSHRKCNN4 | |
| Trifluoromethanesulfonic Acid SCHEMBL29188798 | 0.80 | CA1 (0.47) | CYP1A2MAPTKMT2ACYP2D6ALDH1A1 | |
| Bromide SCHEMBL3629993 | 0.79 | KCNN4 (0.55) | MAPTKMT2AALDH1A1TSHRKCNN4 | |
| Hydrochloric Acid SCHEMBL8387827 | 0.79 | KCNN4 (0.55) | MAPTKMT2AALDH1A1TSHRKCNN4 | |
| Water SCHEMBL4609376 | 0.79 | KCNN4 (0.55) | MAPTKMT2AALDH1A1TSHRKCNN4 | |
| Methylamine SCHEMBL20916863 | 0.79 | KCNN4 (0.55) | MAPTKMT2AALDH1A1TSHRKCNN4 | |
| Bromide SCHEMBL414533 | 0.79 | KCNN4 (0.55) | MAPTKMT2AALDH1A1TSHRKCNN4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111072559-B | Construction and application of 2, 6-dibromopyridine oxidation system | 浙江工商大学 | 2021-06-18 | — | — | CN | disclosed |
| CN-111072559-A | Construction and application of 2, 6-dibromopyridine oxidation system | 浙江工商大学 | 2020-04-28 | — | — | CN | disclosed |